A0A077Z2M2_TRITR Loading...

F-box domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2M2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 491 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	36.8	Very low	45.7	Very low	245 Å²	245	156.8 Å²	156.8	100%	1.207	82%	0.815	S	S	*	*				0	119.9	0	-75.9	-171.2	167.5	0	0	108
2	A	40.4	Very low	45.7	Very low	93 Å²	93	163.8 Å²	163.8	77%	0.769	82%	0.823	S	S	*	*			trans	58.6	71.9	172.9	0	0	0	0	0	118.2	S4	A2-S4 PolarHBondContact O-N 3.45Å
3	D	38.3	Very low	45.9	Very low	183 Å²	183	161.3 Å²	161.3	98%	0.979	82%	0.821	S	S	*	*			trans	-84.1	93	151.1	-112	-27.3	0	0	0	107.6
4	S	39.7	Very low	45.9	Very low	91 Å²	91	157.7 Å²	157.7	64%	0.636	82%	0.816	S	S	*	*			trans	-141.2	126.8	178.3	59.2	0	0	0	0	111.6	A2	A2-S4 PolarHBondContact O-N 3.45Å
5	S	44.5	Very low	45.7	Very low	110 Å²	110	152.5 Å²	152.5	77%	0.769	80%	0.799	S	S	*	*			trans	80.9	72.9	162.5	75.8	0	0	0	0	117.8	S7	S5-S7 PolarHBondContact O-N 2.89Å
6	R	51.7	Low	46.3	Very low	242 Å²	242	150.4 Å²	150.4	91%	0.913	78%	0.778	S	S	*	*			trans	-64.9	88.1	143.6	-85.6	-174.5	-179.2	-175.9	0.9	107.7	V8	R6-V8 PolarHBondContact O-N 3.06Å
7	S	46.7	Very low	46.2	Very low	86 Å²	86	149.9 Å²	149.9	60%	0.601	78%	0.777	S	S	*	*			trans	-55.9	114.1	169.3	63.8	0	0	0	0	108.1	S5 K9	S5-S7 PolarHBondContact O-N 2.89Å; S7-K9 PolarHBondContact O-N 2.8Å
8	V	48.8	Very low	46.3	Very low	141 Å²	141	145.3 Å²	145.3	86%	0.855	76%	0.759	S	S	*	*			trans	-64.4	89.6	170.6	-179.8	0	0	0	0	106.9	R6 K10	R6-V8 PolarHBondContact O-N 3.06Å; V8-K10 PolarHBondContact O-N 3.04Å
9	K	52.5	Low	46.3	Very low	174 Å²	174	143.4 Å²	143.4	76%	0.757	76%	0.756	S	S	*	*			trans	-61.6	112.7	173.7	-80.7	-177.3	176.5	176.2	0	107.1	S7 R11	S7-K9 PolarHBondContact O-N 2.8Å; K9-R11 PolarHBondContact O-N 2.93Å
10	K	52.5	Low	46.4	Very low	205 Å²	205	140.6 Å²	140.6	89%	0.891	75%	0.747	S	S	*	*			trans	-48.9	108.8	168	-85.9	-179	174.3	177	0	107.8	V8 R12	V8-K10 PolarHBondContact O-N 3.04Å; K10-R12 PolarHBondContact O-N 3.32Å
11	R	50.7	Low	46.7	Very low	155 Å²	155	138.3 Å²	138.3	59%	0.585	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-64.6	123.9	-177.7	-73.1	-178	179.3	-163.2	-4.1	108.5	K9 T13 D130	K9-R11 PolarHBondContact O-N 2.93Å; R11-T13 PolarHBondContact O-N 2.93Å; R11-D130 IonicContact CZ-OD2 3.42Å; R11-D130 IonicContact NH2-OD2 3.28Å; R11-D130 PolarHBondContact NH2-OD2 2.96Å
12	R	45.7	Very low	47.2	Very low	241 Å²	241	132.6 Å²	132.6	91%	0.909	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-61.2	119.4	165.7	-77	-178.4	172.8	174.7	-2.9	106.9	K10 C14	K10-R12 PolarHBondContact O-N 3.32Å; R12-C14 PolarHBondContact O-N 3.27Å; R12-C14 VanDerWaalsContact O-N 3.17Å
13	T	48.5	Very low	47.3	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-61.7	116.2	170.4	40.7	0	0	0	0	107.6	R11 S15	R11-T13 PolarHBondContact O-N 2.93Å; T13-S15 VanDerWaalsContact C-N 3.29Å; T13-S15 PolarHBondContact O-N 2.78Å
14	C	45.6	Very low	47.9	Very low	111 Å²	111	131.4 Å²	131.4	75%	0.75	71%	0.71	S	S	*	*			trans	-61.8	97.3	167.5	-86.1	0	0	0	0	107.3	R12 Y16	R12-C14 PolarHBondContact O-N 3.27Å; R12-C14 VanDerWaalsContact O-N 3.17Å; C14-Y16 VanDerWaalsContact C-N 3.27Å; C14-Y16 PolarHBondContact O-N 2.97Å
15	S	43.6	Very low	48.3	Very low	80 Å²	80	134.6 Å²	134.6	56%	0.559	72%	0.719	S	S	*	*			trans	-69.5	89.1	171.8	164	0	0	0	0	107.7	T13 N17	T13-S15 VanDerWaalsContact C-N 3.29Å; T13-S15 PolarHBondContact O-N 2.78Å; S15-N17 PolarHBondContact O-N 3.25Å; S15-N17 PolarHBondContact OG-ND2 3.15Å; S15-N17 PolarHBondContact OG-OD1 3.34Å
16	Y	54.3	Low	48.7	Very low	119 Å²	119	133.8 Å²	133.8	47%	0.467	71%	0.71	S	S	.	*			trans	-69.4	81.7	154.3	-85.2	-85.6	0	0	0	107	C14 C18 G95	C14-Y16 VanDerWaalsContact C-N 3.27Å; C14-Y16 PolarHBondContact O-N 2.97Å; Y16-C18 PolarHBondContact O-N 3.23Å; Y16-G95 WeakPolarHBondContact OH-CA 3.43Å
17	N	45.4	Very low	48.9	Very low	141 Å²	141	127 Å²	127	75%	0.754	72%	0.715	S	S	*	*			trans	-72.5	69.7	161.3	-76	-14.1	0	0	0	107.7	S15 P19	S15-N17 PolarHBondContact O-N 3.25Å; S15-N17 PolarHBondContact OG-ND2 3.15Å; S15-N17 PolarHBondContact OG-OD1 3.34Å; N17-P19 WeakPolarHBondContact O-CD 3.19Å
18	C	48.6	Very low	49.7	Very low	68 Å²	68	130.8 Å²	130.8	46%	0.459	72%	0.721	S	S	.	*			trans	-71.1	111.9	154.6	-84.8	0	0	0	0	105.6	Y16	Y16-C18 PolarHBondContact O-N 3.23Å
19	P	44.5	Very low	50.1	Low	109 Å²	109	130.4 Å²	130.4	71%	0.708	72%	0.721	S	S	*	*			trans	-56.9	138.1	172	24.6	-33.7	0	0	0	108.4	N17 A21	N17-P19 WeakPolarHBondContact O-CD 3.19Å; P19-A21 PolarHBondContact O-N 3.17Å
20	P	49.8	Very low	50.4	Low	86 Å²	86	125.4 Å²	125.4	56%	0.558	71%	0.712	S	S	*	*			trans	-60	105.6	-179.7	22.4	-31	0	0	0	109	L22	P20-L22 PolarHBondContact O-N 2.85Å
21	A	52.3	Low	50.8	Low	93 Å²	93	120 Å²	120	77%	0.769	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-62.1	-12.4	-175.5	0	0	0	0	0	113.6	P19 N23	P19-A21 PolarHBondContact O-N 3.17Å; A21-N23 PolarHBondContact O-N 2.64Å
22	L	46.1	Very low	51.3	Low	126 Å²	126	116.6 Å²	116.6	66%	0.66	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-77.5	-16.3	-174	-84.8	152.7	0	0	0	114.8	P20 V61	P20-L22 PolarHBondContact O-N 2.85Å; L22-V61 HydrophobicContact CD1-CG1 4.25Å
23	N	44.3	Very low	52.6	Low	127 Å²	127	107.6 Å²	107.6	68%	0.679	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-86.2	-8.9	-172.1	-75.8	-5.7	0	0	0	115.4	A21	A21-N23 PolarHBondContact O-N 2.64Å
24	C	50.5	Low	54.1	Low	123 Å²	123	109 Å²	109	83%	0.831	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-92.5	-9	-170.8	-76.7	0	0	0	0	116.3
25	L	47.7	Very low	56	Low	158 Å²	158	107.1 Å²	107.1	83%	0.827	66%	0.658	S	S	*	*	S	Bend	trans	-103.5	-18.4	-167.1	-75.7	171.5	0	0	0	116.6
26	T	53.1	Low	57.9	Low	94 Å²	94	105.6 Å²	105.6	58%	0.577	64%	0.644	S	S	*	*			trans	-143.9	111.9	178.8	59.3	0	0	0	0	109.8	K28	T26-K28 PolarHBondContact O-N 3.3Å; T26-K28 VanDerWaalsContact O-O 3.14Å
27	G	56.6	Low	59.6	Low	98 Å²	98	108.9 Å²	108.9	100%	1.01	66%	0.655	S	S	*	*	S	Bend	trans	-66.3	26.4	177.4	0	0	0	0	0	115.1
28	K	63	Low	61.7	Low	167 Å²	167	105 Å²	105	73%	0.726	63%	0.634	S	S	*	*	S	Bend	trans	-100.2	143.1	168.2	-69.9	-176.3	177.9	-179.7	0	107.6	T26 A30	T26-K28 PolarHBondContact O-N 3.3Å; T26-K28 VanDerWaalsContact O-O 3.14Å; K28-A30 VanDerWaalsContact C-N 3.34Å; K28-A30 PolarHBondContact O-N 3.45Å
29	P	57.5	Low	63.9	Low	133 Å²	133	105.1 Å²	105.1	86%	0.864	63%	0.634	S	S	*	*			trans	-56.6	103.9	169.9	23.6	-31.1	0	0	0	107.3	A31	P29-A31 PolarHBondContact O-N 3.34Å
30	A	57.8	Low	66.3	Low	68 Å²	68	102.1 Å²	102.1	56%	0.562	61%	0.611	S	S	*	*			trans	-56.9	117.1	-176.4	0	0	0	0	0	106.8	K28 V32	K28-A30 VanDerWaalsContact C-N 3.34Å; K28-A30 PolarHBondContact O-N 3.45Å; A30-V32 PolarHBondContact O-N 3.09Å
31	A	61.9	Low	68.5	Low	93 Å²	93	104.1 Å²	104.1	77%	0.769	61%	0.613	S	S	*	*			trans	-48.3	114.4	169.3	0	0	0	0	0	106.2	P29 A33	P29-A31 PolarHBondContact O-N 3.34Å; A31-A33 PolarHBondContact O-N 3.42Å
32	V	61.1	Low	70.5	Confident	83 Å²	83	104.8 Å²	104.8	50%	0.503	60%	0.602	S	S	.	*			trans	-52.4	111.4	-176.1	176.2	0	0	0	0	106.2	A30 H34 L36	A30-V32 PolarHBondContact O-N 3.09Å; V32-H34 PolarHBondContact O-N 2.65Å; V32-H34 VanDerWaalsContact O-N 3.08Å; V32-L36 HydrophobicContact CG1-CB 4.3Å; V32-L36 HydrophobicContact CG1-CD1 4.49Å
33	A	71.9	Confident	72.8	Confident	52 Å²	52	98.8 Å²	98.8	43%	0.43	57%	0.571	S	S	.	*			trans	-50.9	123.1	-172.8	0	0	0	0	0	108.3	A31 I35 L36	A31-A33 PolarHBondContact O-N 3.42Å; A33-I35 HydrophobicContact CB-CG2 4.02Å; A33-I35 PolarHBondContact O-N 2.78Å; A33-L36 WeakPolarHBondContact O-CB 3.38Å; A33-L36 PolarHBondContact O-N 3.05Å
34	H	80.9	Confident	75.2	Confident	160 Å²	160	95.1 Å²	95.1	74%	0.741	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-50.3	-28.4	-172.1	-72.5	-82.4	0	0	0	113	V32 L36 R37	V32-H34 PolarHBondContact O-N 2.65Å; V32-H34 VanDerWaalsContact O-N 3.08Å; H34-L36 VanDerWaalsContact C-N 3.27Å; H34-L36 PolarHBondContact O-N 2.56Å; H34-R37 PolarHBondContact O-N 2.93Å
35	I	84.7	Confident	77.3	Confident	71 Å²	71	95.6 Å²	95.6	36%	0.364	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-58.3	-31.7	175.4	-158.3	165.6	0	0	0	113.9	A33 R37 L38 L43 F65	A33-I35 HydrophobicContact CB-CG2 4.02Å; A33-I35 PolarHBondContact O-N 2.78Å; I35-R37 PolarHBondContact O-N 3.2Å; I35-L38 HydrophobicContact CG1-CD1 3.94Å; I35-L38 WeakPolarHBondContact O-CB 3.3Å; I35-L38 PolarHBondContact O-N 3.37Å; I35-L43 HydrophobicContact CG1-CD2 4.12Å; I35-F65 HydrophobicContact CD1-CZ 3.84Å; I35-F65 HydrophobicContact CG1-CZ 3.96Å; I35-F65 HydrophobicContact CG2-CE2 4.4Å; I35-F65 HydrophobicContact CG2-CZ 4.45Å
36	L	84.3	Confident	79.4	Confident	49 Å²	49	91.2 Å²	91.2	26%	0.257	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-77.6	-1	177.6	-61.5	177.1	0	0	0	113.5	V32 A33 H34 S62 Q64 F65	V32-L36 HydrophobicContact CG1-CB 4.3Å; V32-L36 HydrophobicContact CG1-CD1 4.49Å; A33-L36 WeakPolarHBondContact O-CB 3.38Å; A33-L36 PolarHBondContact O-N 3.05Å; H34-L36 VanDerWaalsContact C-N 3.27Å; H34-L36 PolarHBondContact O-N 2.56Å; L36-S62 WeakPolarHBondContact CD2-OG 3.44Å; L36-Q64 VanDerWaalsContact O-CD 3.3Å; L36-Q64 PolarHBondContact O-NE2 2.85Å; L36-Q64 PolarHBondContact O-OE1 3.21Å; L36-F65 HydrophobicContact CD2-CD2 4.06Å; L36-F65 HydrophobicContact CD2-CE2 3.84Å
37	R	88.7	Confident	81.3	Confident	187 Å²	187	86.8 Å²	86.8	71%	0.706	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-105	-3.3	172.6	-65.5	-173.2	175.2	-174.4	-0.8	112.6	H34 I35	H34-R37 PolarHBondContact O-N 2.93Å; I35-R37 PolarHBondContact O-N 3.2Å
38	L	90.7	Very high	83.1	Confident	59 Å²	59	86.8 Å²	86.8	31%	0.309	46%	0.458	S	S	.	.	S	Bend	trans	-67.2	141	177.7	-65.7	177.8	0	0	0	110.2	I35 M42 L43 I46	I35-L38 HydrophobicContact CG1-CD1 3.94Å; I35-L38 WeakPolarHBondContact O-CB 3.3Å; I35-L38 PolarHBondContact O-N 3.37Å; L38-M42 HydrophobicContact CB-CB 4.22Å; L38-L43 HydrophobicContact CB-CD2 4.16Å; L38-L43 HydrophobicContact CB-CG 4.15Å; L38-L43 HydrophobicContact CD1-CD2 4.19Å; L38-I46 HydrophobicContact CD1-CD1 3.66Å
39	P	94.8	Very high	84.5	Confident	72 Å²	72	85.2 Å²	85.2	47%	0.468	45%	0.452	S	S	.	.			trans	-53.4	150.9	168.2	-25.2	34.4	0	0	0	111.6	E41 M42 L43	P39-E41 VanDerWaalsContact CB-OE2 3.3Å; P39-E41 WeakPolarHBondContact CB-OE2 3.13Å; P39-E41 PolarHBondContact O-N 2.84Å; P39-M42 HydrophobicContact CG-CG 4.49Å; P39-M42 WeakPolarHBondContact O-CB 3.39Å; P39-M42 PolarHBondContact O-N 3.35Å; P39-L43 PolarHBondContact O-N 3.36Å; P39-L43 VanDerWaalsContact O-N 3.12Å
40	I	95.3	Very high	86.2	Confident	45 Å²	45	82.1 Å²	82.1	23%	0.231	43%	0.427	C	S	.	.	H	α-helix	trans	-60.7	-32.6	-175.2	-167.4	70.5	0	0	0	111.8	L43 M44 Q64 T67 A68 L71	I40-L43 HydrophobicContact CD1-CD1 4.49Å; I40-L43 PolarHBondContact O-N 2.82Å; I40-M44 WeakPolarHBondContact O-CG 3.46Å; I40-M44 PolarHBondContact O-N 2.62Å; I40-Q64 WeakPolarHBondContact CD1-O 3.31Å; I40-T67 HydrophobicContact CD1-CG2 4.17Å; I40-A68 HydrophobicContact CD1-CB 3.66Å; I40-A68 HydrophobicContact CG1-CB 4.39Å; I40-L71 HydrophobicContact CG1-CD1 4.06Å
41	E	95.6	Very high	87.8	Confident	129 Å²	129	83.7 Å²	83.7	60%	0.603	43%	0.426	S	S	*	.	H	α-helix	trans	-64.7	-40.5	177.4	-57.9	75.6	-164.7	0	0	111.3	P39 M44 Y45	P39-E41 VanDerWaalsContact CB-OE2 3.3Å; P39-E41 WeakPolarHBondContact CB-OE2 3.13Å; P39-E41 PolarHBondContact O-N 2.84Å; E41-M44 PolarHBondContact O-N 2.93Å; E41-Y45 WeakPolarHBondContact O-CB 3.47Å; E41-Y45 PolarHBondContact O-N 3.25Å
42	M	94.6	Very high	89	Confident	106 Å²	106	82.4 Å²	82.4	52%	0.522	40%	0.404	S	S	.	.	H	α-helix	trans	-68.3	-39.2	175.4	-73.3	-74.7	173.9	0	0	111.1	L38 P39 Y45 I46	L38-M42 HydrophobicContact CB-CB 4.22Å; P39-M42 HydrophobicContact CG-CG 4.49Å; P39-M42 WeakPolarHBondContact O-CB 3.39Å; P39-M42 PolarHBondContact O-N 3.35Å; M42-Y45 WeakPolarHBondContact O-CB 3.39Å; M42-Y45 PolarHBondContact O-N 3.42Å; M42-I46 VanDerWaalsContact O-CG1 3.3Å; M42-I46 WeakPolarHBondContact O-CG1 3.45Å; M42-I46 PolarHBondContact O-N 2.99Å
43	L	94	Very high	90.3	Very high	1 Å²	1	80.1 Å²	80.1	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-63.7	-45.2	174.1	-70.2	177.2	0	0	0	111.5	I35 L38 P39 I40 Y45 I46 L47 Q64 F65 A68	I35-L43 HydrophobicContact CG1-CD2 4.12Å; L38-L43 HydrophobicContact CB-CD2 4.16Å; L38-L43 HydrophobicContact CB-CG 4.15Å; L38-L43 HydrophobicContact CD1-CD2 4.19Å; P39-L43 PolarHBondContact O-N 3.36Å; P39-L43 VanDerWaalsContact O-N 3.12Å; I40-L43 HydrophobicContact CD1-CD1 4.49Å; I40-L43 PolarHBondContact O-N 2.82Å; L43-Y45 VanDerWaalsContact C-N 3.3Å; L43-Y45 PolarHBondContact O-N 3.36Å; L43-I46 PolarHBondContact O-N 3.08Å; L43-L47 WeakPolarHBondContact O-CB 3.27Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.17Å; L43-Q64 HydrophobicContact CD1-CB 3.99Å; L43-F65 HydrophobicContact CD2-CE1 3.9Å; L43-F65 HydrophobicContact CD2-CZ 3.94Å; L43-A68 HydrophobicContact CB-CB 3.98Å
44	M	94.4	Very high	91.1	Very high	50 Å²	50	80.7 Å²	80.7	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-59	-43.6	174.4	-72.4	177.3	62.9	0	0	111.5	I40 E41 I46 L47 Q48 A68 L71 L72	I40-M44 WeakPolarHBondContact O-CG 3.46Å; I40-M44 PolarHBondContact O-N 2.62Å; E41-M44 PolarHBondContact O-N 2.93Å; M44-I46 PolarHBondContact O-N 3.33Å; M44-L47 PolarHBondContact O-N 2.92Å; M44-Q48 PolarHBondContact O-N 2.76Å; M44-A68 HydrophobicContact CG-CB 4Å; M44-L71 HydrophobicContact CE-CB 3.72Å; M44-L71 HydrophobicContact CG-CB 4.47Å; M44-L71 HydrophobicContact SD-CB 3.62Å; M44-L71 HydrophobicContact SD-CD1 3.57Å; M44-L71 VanDerWaalsContact SD-CD1 3.57Å; M44-L71 HydrophobicContact SD-CG 4.23Å; M44-L72 HydrophobicContact CB-CD2 4.27Å; M44-L72 HydrophobicContact CB-CG 4.4Å; M44-L72 HydrophobicContact CE-CD2 4.06Å; M44-L72 HydrophobicContact CE-CG 4.38Å; M44-L72 HydrophobicContact CG-CG 4.31Å
45	Y	93.8	Very high	91.7	Very high	133 Å²	133	73.9 Å²	73.9	52%	0.522	35%	0.352	S	S	.	.	H	α-helix	trans	-59.4	-45	175.8	-177.5	-97.1	0	0	0	111.6	E41 M42 L43 Q48 F49	E41-Y45 WeakPolarHBondContact O-CB 3.47Å; E41-Y45 PolarHBondContact O-N 3.25Å; M42-Y45 WeakPolarHBondContact O-CB 3.39Å; M42-Y45 PolarHBondContact O-N 3.42Å; L43-Y45 VanDerWaalsContact C-N 3.3Å; L43-Y45 PolarHBondContact O-N 3.36Å; Y45-Q48 VanDerWaalsContact CE2-NE2 3.25Å; Y45-Q48 WeakPolarHBondContact O-CG 3.22Å; Y45-Q48 PolarHBondContact O-NE2 3.17Å; Y45-F49 AromaticContact CD1-CE2 3.85Å; Y45-F49 HydrophobicContact CD1-CE2 3.85Å; Y45-F49 HydrophobicContact CD2-CE2 4.22Å; Y45-F49 HydrophobicContact CE1-CD2 4.46Å; Y45-F49 AromaticContact CE1-CE2 3.47Å; Y45-F49 HydrophobicContact CE1-CE2 3.47Å; Y45-F49 VanDerWaalsContact CE1-CE2 3.47Å; Y45-F49 HydrophobicContact CE1-CZ 4.11Å; Y45-F49 AromaticContact CE2-CE2 3.86Å; Y45-F49 HydrophobicContact CE2-CE2 3.86Å; Y45-F49 HydrophobicContact CE2-CZ 4.02Å; Y45-F49 HydrophobicContact CG-CE2 4.2Å; Y45-F49 AromaticContact CZ-CE2 3.46Å; Y45-F49 VanDerWaalsContact CZ-CE2 3.46Å; Y45-F49 AromaticContact CZ-CZ 3.66Å; Y45-F49 WeakPolarHBondContact O-CD2 3.41Å; Y45-F49 WeakPolarHBondContact O-CE2 3.39Å
46	I	93	Very high	91.6	Very high	66 Å²	66	71.4 Å²	71.4	34%	0.338	34%	0.341	S	S	.	.	H	α-helix	trans	-64.5	-47.1	176.8	-67.8	163.6	0	0	0	111	L38 M42 L43 M44 Q48 F49	L38-I46 HydrophobicContact CD1-CD1 3.66Å; M42-I46 VanDerWaalsContact O-CG1 3.3Å; M42-I46 WeakPolarHBondContact O-CG1 3.45Å; M42-I46 PolarHBondContact O-N 2.99Å; L43-I46 PolarHBondContact O-N 3.08Å; M44-I46 PolarHBondContact O-N 3.33Å; I46-Q48 VanDerWaalsContact C-N 3.26Å; I46-Q48 PolarHBondContact O-N 3.29Å; I46-F49 PolarHBondContact O-N 3.02Å; I46-F49 VanDerWaalsContact O-N 3.13Å
47	L	93.5	Very high	91.8	Very high	0 Å²	0	76.6 Å²	76.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-28.8	-176.1	-73.8	175.5	0	0	0	113.1	L43 M44 F49 L50 W55 L58 F65 A68 V69 L72	L43-L47 WeakPolarHBondContact O-CB 3.27Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.17Å; M44-L47 PolarHBondContact O-N 2.92Å; L47-F49 PolarHBondContact O-N 3.2Å; L47-L50 HydrophobicContact CD2-CD1 3.97Å; L47-L50 WeakPolarHBondContact O-CB 3.42Å; L47-L50 PolarHBondContact O-N 2.86Å; L47-W55 PolarHBondContact O-NE1 3.13Å; L47-W55 VanDerWaalsContact O-NE1 3.08Å; L47-L58 HydrophobicContact CD2-CB 4.25Å; L47-L58 HydrophobicContact CD2-CD1 3.31Å; L47-L58 HydrophobicContact CD2-CG 4.38Å; L47-F65 HydrophobicContact CD1-CD1 4.39Å; L47-F65 HydrophobicContact CD2-CD1 4.18Å; L47-F65 HydrophobicContact CD2-CE1 4.33Å; L47-A68 HydrophobicContact CD1-CB 3.56Å; L47-V69 HydrophobicContact CD1-CG2 3.73Å; L47-L72 HydrophobicContact CB-CD1 3.3Å; L47-L72 HydrophobicContact CD1-CD1 3.95Å; L47-L72 HydrophobicContact CG-CD1 4.29Å
48	Q	93.1	Very high	91.9	Very high	99 Å²	99	69.4 Å²	69.4	46%	0.463	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.4	177.6	90.7	-161.2	-19.6	0	0	113	M44 Y45 I46 L50	M44-Q48 PolarHBondContact O-N 2.76Å; Y45-Q48 VanDerWaalsContact CE2-NE2 3.25Å; Y45-Q48 WeakPolarHBondContact O-CG 3.22Å; Y45-Q48 PolarHBondContact O-NE2 3.17Å; I46-Q48 VanDerWaalsContact C-N 3.26Å; I46-Q48 PolarHBondContact O-N 3.29Å; Q48-L50 VanDerWaalsContact C-N 3.34Å
49	F	93.5	Very high	91.9	Very high	133 Å²	133	66.9 Å²	66.9	58%	0.583	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.1	175.1	-62.7	-77.3	0	0	0	112.8	Y45 I46 L47	Y45-F49 AromaticContact CD1-CE2 3.85Å; Y45-F49 HydrophobicContact CD1-CE2 3.85Å; Y45-F49 HydrophobicContact CD2-CE2 4.22Å; Y45-F49 HydrophobicContact CE1-CD2 4.46Å; Y45-F49 AromaticContact CE1-CE2 3.47Å; Y45-F49 HydrophobicContact CE1-CE2 3.47Å; Y45-F49 VanDerWaalsContact CE1-CE2 3.47Å; Y45-F49 HydrophobicContact CE1-CZ 4.11Å; Y45-F49 AromaticContact CE2-CE2 3.86Å; Y45-F49 HydrophobicContact CE2-CE2 3.86Å; Y45-F49 HydrophobicContact CE2-CZ 4.02Å; Y45-F49 HydrophobicContact CG-CE2 4.2Å; Y45-F49 AromaticContact CZ-CE2 3.46Å; Y45-F49 VanDerWaalsContact CZ-CE2 3.46Å; Y45-F49 AromaticContact CZ-CZ 3.66Å; Y45-F49 WeakPolarHBondContact O-CD2 3.41Å; Y45-F49 WeakPolarHBondContact O-CE2 3.39Å; I46-F49 PolarHBondContact O-N 3.02Å; I46-F49 VanDerWaalsContact O-N 3.13Å; L47-F49 PolarHBondContact O-N 3.2Å
50	L	92.5	Very high	91.6	Very high	68 Å²	68	66.5 Å²	66.5	36%	0.356	32%	0.318	S	S	.	.	S	Bend	trans	-95.8	146.1	176.3	-56.7	-177.9	0	0	0	110.1	L47 Q48 E54 W55 L58	L47-L50 HydrophobicContact CD2-CD1 3.97Å; L47-L50 WeakPolarHBondContact O-CB 3.42Å; L47-L50 PolarHBondContact O-N 2.86Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; L50-E54 HydrophobicContact CB-CB 4.47Å; L50-W55 PolarHBondContact O-NE1 3.38Å; L50-L58 HydrophobicContact CD1-CD1 3.32Å
51	D	90.6	Very high	91.3	Very high	101 Å²	101	67.3 Å²	67.3	54%	0.54	32%	0.324	S	S	.	.			trans	-57.6	143.6	172.3	-169	-76.8	0	0	0	110.7	T53 E54	D51-T53 PolarHBondContact O-N 2.87Å; D51-T53 VanDerWaalsContact O-N 3.11Å; D51-T53 WeakPolarHBondContact OD1-CB 3.33Å; D51-T53 WeakPolarHBondContact OD1-CG2 3.41Å; D51-T53 PolarHBondContact OD1-N 2.64Å; D51-T53 PolarHBondContact OD1-OG1 3.3Å; D51-E54 WeakPolarHBondContact O-CB 3.32Å; D51-E54 PolarHBondContact O-N 3.2Å
52	Q	88.8	Confident	91.1	Very high	66 Å²	66	62.4 Å²	62.4	31%	0.308	31%	0.305	S	S	.	.	H	α-helix	trans	-60	-24.5	-178.3	-66.5	-176.1	7.2	0	0	112.7	E54 W55 I84	Q52-E54 PolarHBondContact O-N 3Å; Q52-W55 HydrophobicContact CB-CD2 4.45Å; Q52-W55 HydrophobicContact CG-CD2 4.34Å; Q52-W55 HydrophobicContact CG-CE3 4.38Å; Q52-W55 HydrophobicContact CG-CH2 4.05Å; Q52-W55 HydrophobicContact CG-CZ2 3.99Å; Q52-W55 HydrophobicContact CG-CZ3 4.24Å; Q52-W55 WeakPolarHBondContact O-CB 3.48Å; Q52-W55 PolarHBondContact O-N 3.05Å; Q52-I84 HydrophobicContact CB-CD1 4.29Å; Q52-I84 HydrophobicContact CB-CG1 4.29Å; Q52-I84 VanDerWaalsContact OE1-CD1 3.31Å
53	T	86.6	Confident	91.1	Very high	36 Å²	36	63 Å²	63	22%	0.221	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-32.4	172.4	57.3	0	0	0	0	112.5	D51 I84	D51-T53 PolarHBondContact O-N 2.87Å; D51-T53 VanDerWaalsContact O-N 3.11Å; D51-T53 WeakPolarHBondContact OD1-CB 3.33Å; D51-T53 WeakPolarHBondContact OD1-CG2 3.41Å; D51-T53 PolarHBondContact OD1-N 2.64Å; D51-T53 PolarHBondContact OD1-OG1 3.3Å; T53-I84 HydrophobicContact CG2-CG2 4.34Å; T53-I84 VanDerWaalsContact CG2-O 3.31Å; T53-I84 WeakPolarHBondContact CG2-O 3.46Å
54	E	90.3	Very high	91.1	Very high	63 Å²	63	66.7 Å²	66.7	29%	0.294	32%	0.323	S	S	.	.	H	α-helix	trans	-84.1	-20.8	-178.1	-67.9	-56.8	135.2	0	0	113.2	L50 D51 Q52 V56 R57 L58	L50-E54 HydrophobicContact CB-CB 4.47Å; D51-E54 WeakPolarHBondContact O-CB 3.32Å; D51-E54 PolarHBondContact O-N 3.2Å; Q52-E54 PolarHBondContact O-N 3Å; E54-V56 VanDerWaalsContact C-N 3.31Å; E54-V56 PolarHBondContact O-N 2.99Å; E54-R57 WeakPolarHBondContact O-CB 3.49Å; E54-R57 PolarHBondContact O-N 2.96Å; E54-R57 VanDerWaalsContact O-N 3.14Å; E54-R57 IonicContact OE1-CZ 3.96Å; E54-R57 IonicContact OE1-NH1 3.86Å; E54-R57 PolarHBondContact OE1-NH1 3.43Å; E54-R57 VanDerWaalsContact OE2-CD 3.31Å; E54-R57 WeakPolarHBondContact OE2-CD 3.41Å; E54-R57 IonicContact OE2-NH1 2.84Å; E54-L58 HydrophobicContact CB-CD1 4.4Å; E54-L58 WeakPolarHBondContact O-CG 3.47Å; E54-L58 PolarHBondContact O-N 2.89Å
55	W	92	Very high	91.1	Very high	17 Å²	17	64.8 Å²	64.8	6%	0.064	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-42	-174.1	-69.2	8.8	0	0	0	112.2	L47 L50 Q52 L58 S59 V69 L72 L73 V76	L47-W55 PolarHBondContact O-NE1 3.13Å; L47-W55 VanDerWaalsContact O-NE1 3.08Å; L50-W55 PolarHBondContact O-NE1 3.38Å; Q52-W55 HydrophobicContact CB-CD2 4.45Å; Q52-W55 HydrophobicContact CG-CD2 4.34Å; Q52-W55 HydrophobicContact CG-CE3 4.38Å; Q52-W55 HydrophobicContact CG-CH2 4.05Å; Q52-W55 HydrophobicContact CG-CZ2 3.99Å; Q52-W55 HydrophobicContact CG-CZ3 4.24Å; Q52-W55 WeakPolarHBondContact O-CB 3.48Å; Q52-W55 PolarHBondContact O-N 3.05Å; W55-L58 PolarHBondContact O-N 3.26Å; W55-S59 WeakPolarHBondContact O-CB 3.29Å; W55-S59 PolarHBondContact O-N 3.03Å; W55-V69 HydrophobicContact CB-CG1 4Å; W55-V69 HydrophobicContact CB-CG2 4.32Å; W55-V69 VanDerWaalsContact O-CG2 3.31Å; W55-V69 WeakPolarHBondContact O-CG2 3.47Å; W55-L72 HydrophobicContact CH2-CB 4.23Å; W55-L72 HydrophobicContact CZ2-CD1 4.48Å; W55-L72 HydrophobicContact CZ3-CB 4.18Å; W55-L73 HydrophobicContact CE3-CD2 3.75Å; W55-L73 HydrophobicContact CE3-CG 4.32Å; W55-L73 HydrophobicContact CZ3-CD2 3.93Å; W55-V76 HydrophobicContact CH2-CG2 4.21Å; W55-V76 HydrophobicContact CZ3-CG2 3.76Å
56	V	84.5	Confident	91.1	Very high	19 Å²	19	61.9 Å²	61.9	12%	0.115	30%	0.302	C	S	.	.	H	α-helix	trans	-74	-35.7	179.7	178.5	0	0	0	0	111.8	E54 L58 S59 C60 F96 Y99	E54-V56 VanDerWaalsContact C-N 3.31Å; E54-V56 PolarHBondContact O-N 2.99Å; V56-L58 VanDerWaalsContact C-N 3.27Å; V56-L58 PolarHBondContact O-N 3.38Å; V56-S59 WeakPolarHBondContact CA-OG 3.3Å; V56-S59 WeakPolarHBondContact O-CB 3.46Å; V56-S59 PolarHBondContact O-N 3.1Å; V56-S59 PolarHBondContact O-OG 3.32Å; V56-C60 PolarHBondContact O-N 3.1Å; V56-C60 PolarHBondContact O-SG 3.34Å; V56-F96 HydrophobicContact CB-CD2 3.45Å; V56-F96 VanDerWaalsContact CB-CD2 3.45Å; V56-F96 HydrophobicContact CB-CE2 3.21Å; V56-F96 HydrophobicContact CB-CZ 4.12Å; V56-F96 HydrophobicContact CG1-CD2 3.47Å; V56-F96 VanDerWaalsContact CG1-CD2 3.47Å; V56-F96 HydrophobicContact CG1-CE2 3.83Å; V56-F96 HydrophobicContact CG1-CG 4.38Å; V56-F96 HydrophobicContact CG2-CD2 3.43Å; V56-F96 VanDerWaalsContact CG2-CD2 3.43Å; V56-F96 HydrophobicContact CG2-CE1 4.27Å; V56-F96 HydrophobicContact CG2-CE2 3.03Å; V56-F96 HydrophobicContact CG2-CG 4.21Å; V56-F96 HydrophobicContact CG2-CZ 3.44Å; V56-F96 VanDerWaalsContact CG2-CZ 3.44Å; V56-Y99 HydrophobicContact CG2-CD1 4.27Å
57	R	87.1	Confident	91.3	Very high	159 Å²	159	61.3 Å²	61.3	60%	0.6	30%	0.302	S	S	*	.	H	α-helix	trans	-57.4	-46.3	172.7	-69.4	177.1	173.9	172.6	-0.8	110.2	E54 S59 C60	E54-R57 WeakPolarHBondContact O-CB 3.49Å; E54-R57 PolarHBondContact O-N 2.96Å; E54-R57 VanDerWaalsContact O-N 3.14Å; E54-R57 IonicContact OE1-CZ 3.96Å; E54-R57 IonicContact OE1-NH1 3.86Å; E54-R57 PolarHBondContact OE1-NH1 3.43Å; E54-R57 VanDerWaalsContact OE2-CD 3.31Å; E54-R57 WeakPolarHBondContact OE2-CD 3.41Å; E54-R57 IonicContact OE2-NH1 2.84Å; R57-S59 PolarHBondContact O-N 3.45Å; R57-C60 WeakPolarHBondContact O-CB 3.43Å; R57-C60 PolarHBondContact O-N 3.5Å
58	L	90.9	Very high	91.4	Very high	36 Å²	36	61.3 Å²	61.3	19%	0.188	30%	0.302	C	S	.	.	H	α-helix	trans	-68	-33.7	178.1	-66.2	170	0	0	0	112.5	L47 L50 E54 W55 V56 C60 V61 F65	L47-L58 HydrophobicContact CD2-CB 4.25Å; L47-L58 HydrophobicContact CD2-CD1 3.31Å; L47-L58 HydrophobicContact CD2-CG 4.38Å; L50-L58 HydrophobicContact CD1-CD1 3.32Å; E54-L58 HydrophobicContact CB-CD1 4.4Å; E54-L58 WeakPolarHBondContact O-CG 3.47Å; E54-L58 PolarHBondContact O-N 2.89Å; W55-L58 PolarHBondContact O-N 3.26Å; V56-L58 VanDerWaalsContact C-N 3.27Å; V56-L58 PolarHBondContact O-N 3.38Å; L58-C60 PolarHBondContact O-N 3.44Å; L58-C60 VanDerWaalsContact O-N 3.12Å; L58-V61 HydrophobicContact CD2-CG2 4.32Å; L58-V61 WeakPolarHBondContact O-CB 3.44Å; L58-V61 PolarHBondContact O-N 3.19Å; L58-F65 HydrophobicContact CB-CD1 4.2Å; L58-F65 WeakPolarHBondContact O-CB 3.31Å
59	S	90.8	Very high	91.6	Very high	5 Å²	5	56.6 Å²	56.6	4%	0.035	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-19.1	175.3	81.9	0	0	0	0	114.1	W55 V56 R57 R66	W55-S59 WeakPolarHBondContact O-CB 3.29Å; W55-S59 PolarHBondContact O-N 3.03Å; V56-S59 WeakPolarHBondContact CA-OG 3.3Å; V56-S59 WeakPolarHBondContact O-CB 3.46Å; V56-S59 PolarHBondContact O-N 3.1Å; V56-S59 PolarHBondContact O-OG 3.32Å; R57-S59 PolarHBondContact O-N 3.45Å; S59-R66 WeakPolarHBondContact O-CB 3.27Å; S59-R66 PolarHBondContact O-NE 3.18Å
60	C	89	Confident	91.7	Very high	65 Å²	65	50.9 Å²	50.9	44%	0.439	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-11.4	175	-64.4	0	0	0	0	113.3	V56 R57 L58	V56-C60 PolarHBondContact O-N 3.1Å; V56-C60 PolarHBondContact O-SG 3.34Å; R57-C60 WeakPolarHBondContact O-CB 3.43Å; R57-C60 PolarHBondContact O-N 3.5Å; L58-C60 PolarHBondContact O-N 3.44Å; L58-C60 VanDerWaalsContact O-N 3.12Å
61	V	89.4	Confident	91.9	Very high	61 Å²	61	50.3 Å²	50.3	37%	0.37	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-48.7	-175.2	176.7	0	0	0	0	111.7	L22 L58 F65	L22-V61 HydrophobicContact CD1-CG1 4.25Å; L58-V61 HydrophobicContact CD2-CG2 4.32Å; L58-V61 WeakPolarHBondContact O-CB 3.44Å; L58-V61 PolarHBondContact O-N 3.19Å; V61-F65 HydrophobicContact CB-CD2 4.24Å; V61-F65 HydrophobicContact CG1-CD2 4.15Å; V61-F65 HydrophobicContact CG1-CE2 4.41Å
62	S	91.5	Very high	92.2	Very high	27 Å²	27	46.1 Å²	46.1	19%	0.189	23%	0.231	C	C	.	.			trans	-155.1	163.8	-179.3	84.5	0	0	0	0	112.3	L36 Q64 F65 R66	L36-S62 WeakPolarHBondContact CD2-OG 3.44Å; S62-Q64 VanDerWaalsContact C-N 3.26Å; S62-Q64 PolarHBondContact O-N 3.31Å; S62-Q64 PolarHBondContact OG-N 2.96Å; S62-F65 PolarHBondContact O-N 3.5Å; S62-F65 WeakPolarHBondContact OG-CD2 3.38Å; S62-F65 PolarHBondContact OG-N 3.04Å; S62-R66 WeakPolarHBondContact O-CB 3.34Å; S62-R66 PolarHBondContact O-N 2.91Å
63	Q	93.5	Very high	92.6	Very high	119 Å²	119	43 Å²	43	56%	0.556	22%	0.216	S	C	*	.	H	α-helix	trans	-63.1	-31.8	176.1	-175.8	59.7	25	0	0	112.7	R66 T67	Q63-R66 VanDerWaalsContact OE1-NH1 3.1Å; Q63-T67 WeakPolarHBondContact O-CB 3.23Å; Q63-T67 PolarHBondContact O-N 3.3Å; Q63-T67 PolarHBondContact O-OG1 3.24Å
64	Q	93.9	Very high	93	Very high	78 Å²	78	47.9 Å²	47.9	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-67.3	-49.3	175.3	-74.7	177.1	-3.6	0	0	111.2	L36 I40 L43 S62 R66 T67 A68	L36-Q64 VanDerWaalsContact O-CD 3.3Å; L36-Q64 PolarHBondContact O-NE2 2.85Å; L36-Q64 PolarHBondContact O-OE1 3.21Å; I40-Q64 WeakPolarHBondContact CD1-O 3.31Å; L43-Q64 HydrophobicContact CD1-CB 3.99Å; S62-Q64 VanDerWaalsContact C-N 3.26Å; S62-Q64 PolarHBondContact O-N 3.31Å; S62-Q64 PolarHBondContact OG-N 2.96Å; Q64-R66 VanDerWaalsContact C-N 3.31Å; Q64-R66 PolarHBondContact O-N 3.26Å; Q64-T67 WeakPolarHBondContact O-CB 3.29Å; Q64-T67 PolarHBondContact O-N 3.15Å; Q64-T67 VanDerWaalsContact O-N 3.12Å; Q64-A68 PolarHBondContact O-N 3.4Å
65	F	94.3	Very high	93.3	Very high	10 Å²	10	48.8 Å²	48.8	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-42.8	175.4	-83.1	-73.8	0	0	0	111.5	I35 L36 L43 L47 L58 V61 S62 T67 A68 V69	I35-F65 HydrophobicContact CD1-CZ 3.84Å; I35-F65 HydrophobicContact CG1-CZ 3.96Å; I35-F65 HydrophobicContact CG2-CE2 4.4Å; I35-F65 HydrophobicContact CG2-CZ 4.45Å; L36-F65 HydrophobicContact CD2-CD2 4.06Å; L36-F65 HydrophobicContact CD2-CE2 3.84Å; L43-F65 HydrophobicContact CD2-CE1 3.9Å; L43-F65 HydrophobicContact CD2-CZ 3.94Å; L47-F65 HydrophobicContact CD1-CD1 4.39Å; L47-F65 HydrophobicContact CD2-CD1 4.18Å; L47-F65 HydrophobicContact CD2-CE1 4.33Å; L58-F65 HydrophobicContact CB-CD1 4.2Å; L58-F65 WeakPolarHBondContact O-CB 3.31Å; V61-F65 HydrophobicContact CB-CD2 4.24Å; V61-F65 HydrophobicContact CG1-CD2 4.15Å; V61-F65 HydrophobicContact CG1-CE2 4.41Å; S62-F65 PolarHBondContact O-N 3.5Å; S62-F65 WeakPolarHBondContact OG-CD2 3.38Å; S62-F65 PolarHBondContact OG-N 3.04Å; F65-T67 VanDerWaalsContact C-N 3.28Å; F65-T67 PolarHBondContact O-N 3.09Å; F65-A68 PolarHBondContact O-N 3.38Å; F65-V69 WeakPolarHBondContact O-CB 3.46Å; F65-V69 VanDerWaalsContact O-CG2 3.22Å; F65-V69 WeakPolarHBondContact O-CG2 3.36Å; F65-V69 PolarHBondContact O-N 3.07Å
66	R	94.8	Very high	93.5	Very high	71 Å²	71	48.5 Å²	48.5	27%	0.268	24%	0.244	S	C	.	.	H	α-helix	trans	-56	-44.4	174.3	-170.3	-175.6	-65.4	173.4	-11.2	112	S59 S62 Q63 Q64 S70 Y99	S59-R66 WeakPolarHBondContact O-CB 3.27Å; S59-R66 PolarHBondContact O-NE 3.18Å; S62-R66 WeakPolarHBondContact O-CB 3.34Å; S62-R66 PolarHBondContact O-N 2.91Å; Q63-R66 VanDerWaalsContact OE1-NH1 3.1Å; Q64-R66 VanDerWaalsContact C-N 3.31Å; Q64-R66 PolarHBondContact O-N 3.26Å; R66-S70 VanDerWaalsContact O-CB 3.28Å; R66-S70 WeakPolarHBondContact O-CB 3.47Å; R66-S70 PolarHBondContact O-N 2.66Å; R66-S70 PolarHBondContact O-OG 3.4Å; R66-Y99 HydrophobicContact CG-CE2 4.33Å; R66-Y99 WeakPolarHBondContact CG-OH 3.45Å; R66-Y99 PolarHBondContact O-OH 3.1Å
67	T	95.7	Very high	94.1	Very high	55 Å²	55	54.7 Å²	54.7	34%	0.337	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-45.4	178.1	-56.1	0	0	0	0	110.8	I40 Q63 Q64 F65 S70 L71	I40-T67 HydrophobicContact CD1-CG2 4.17Å; Q63-T67 WeakPolarHBondContact O-CB 3.23Å; Q63-T67 PolarHBondContact O-N 3.3Å; Q63-T67 PolarHBondContact O-OG1 3.24Å; Q64-T67 WeakPolarHBondContact O-CB 3.29Å; Q64-T67 PolarHBondContact O-N 3.15Å; Q64-T67 VanDerWaalsContact O-N 3.12Å; F65-T67 VanDerWaalsContact C-N 3.28Å; F65-T67 PolarHBondContact O-N 3.09Å; T67-S70 WeakPolarHBondContact O-CB 3.39Å; T67-S70 PolarHBondContact O-N 3.48Å; T67-L71 HydrophobicContact CG2-CD1 4.38Å; T67-L71 WeakPolarHBondContact O-CG 3.42Å; T67-L71 PolarHBondContact O-N 2.71Å
68	A	96.4	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-47.4	179.2	0	0	0	0	0	111.4	I40 L43 M44 L47 Q64 F65 S70 L71 L72	I40-A68 HydrophobicContact CD1-CB 3.66Å; I40-A68 HydrophobicContact CG1-CB 4.39Å; L43-A68 HydrophobicContact CB-CB 3.98Å; M44-A68 HydrophobicContact CG-CB 4Å; L47-A68 HydrophobicContact CD1-CB 3.56Å; Q64-A68 PolarHBondContact O-N 3.4Å; F65-A68 PolarHBondContact O-N 3.38Å; A68-S70 VanDerWaalsContact C-N 3.33Å; A68-S70 PolarHBondContact O-N 2.91Å; A68-L71 PolarHBondContact O-N 3.19Å; A68-L72 PolarHBondContact O-N 3.41Å
69	V	96.3	Very high	94.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.4	-44.8	174.2	170.8	0	0	0	0	110.5	L47 W55 F65 L71 L72 L73 Y99	L47-V69 HydrophobicContact CD1-CG2 3.73Å; W55-V69 HydrophobicContact CB-CG1 4Å; W55-V69 HydrophobicContact CB-CG2 4.32Å; W55-V69 VanDerWaalsContact O-CG2 3.31Å; W55-V69 WeakPolarHBondContact O-CG2 3.47Å; F65-V69 WeakPolarHBondContact O-CB 3.46Å; F65-V69 VanDerWaalsContact O-CG2 3.22Å; F65-V69 WeakPolarHBondContact O-CG2 3.36Å; F65-V69 PolarHBondContact O-N 3.07Å; V69-L71 VanDerWaalsContact C-N 3.27Å; V69-L71 PolarHBondContact O-N 3.46Å; V69-L72 PolarHBondContact O-N 3.1Å; V69-L73 HydrophobicContact CG1-CD1 3.86Å; V69-L73 HydrophobicContact CG1-CG 4.11Å; V69-L73 WeakPolarHBondContact O-CB 3.43Å; V69-L73 VanDerWaalsContact O-CG 3.26Å; V69-L73 WeakPolarHBondContact O-CG 3.28Å; V69-L73 PolarHBondContact O-N 3.04Å; V69-Y99 HydrophobicContact CG1-CE1 4.34Å
70	S	96.5	Very high	95.1	Very high	13 Å²	13	50.5 Å²	50.5	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-37.5	177.6	-62.7	0	0	0	0	112.4	R66 T67 A68 R74 Y99 H103	R66-S70 VanDerWaalsContact O-CB 3.28Å; R66-S70 WeakPolarHBondContact O-CB 3.47Å; R66-S70 PolarHBondContact O-N 2.66Å; R66-S70 PolarHBondContact O-OG 3.4Å; T67-S70 WeakPolarHBondContact O-CB 3.39Å; T67-S70 PolarHBondContact O-N 3.48Å; A68-S70 VanDerWaalsContact C-N 3.33Å; A68-S70 PolarHBondContact O-N 2.91Å; S70-R74 WeakPolarHBondContact O-CG 3.41Å; S70-R74 PolarHBondContact O-N 3.26Å; S70-Y99 PolarHBondContact OG-OH 3.13Å; S70-H103 PolarHBondContact OG-CD2 3.45Å; S70-H103 VanDerWaalsContact OG-CD2 3.24Å; S70-H103 PolarHBondContact OG-NE2 2.84Å
71	L	96.9	Very high	95.5	Very high	55 Å²	55	47.4 Å²	47.4	29%	0.288	24%	0.236	S	C	.	.	H	α-helix	trans	-69.5	-40.5	175.7	-69.9	171.5	0	0	0	111.9	I40 M44 T67 A68 V69 R74	I40-L71 HydrophobicContact CG1-CD1 4.06Å; M44-L71 HydrophobicContact CE-CB 3.72Å; M44-L71 HydrophobicContact CG-CB 4.47Å; M44-L71 HydrophobicContact SD-CB 3.62Å; M44-L71 HydrophobicContact SD-CD1 3.57Å; M44-L71 VanDerWaalsContact SD-CD1 3.57Å; M44-L71 HydrophobicContact SD-CG 4.23Å; T67-L71 HydrophobicContact CG2-CD1 4.38Å; T67-L71 WeakPolarHBondContact O-CG 3.42Å; T67-L71 PolarHBondContact O-N 2.71Å; A68-L71 PolarHBondContact O-N 3.19Å; V69-L71 VanDerWaalsContact C-N 3.27Å; V69-L71 PolarHBondContact O-N 3.46Å; L71-R74 WeakPolarHBondContact O-CB 3.47Å; L71-R74 PolarHBondContact O-N 2.95Å
72	L	96.6	Very high	95.6	Very high	14 Å²	14	48.3 Å²	48.3	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-42.4	174	-72.2	175.2	0	0	0	112.2	M44 L47 W55 A68 V69 R74 S75	M44-L72 HydrophobicContact CB-CD2 4.27Å; M44-L72 HydrophobicContact CB-CG 4.4Å; M44-L72 HydrophobicContact CE-CD2 4.06Å; M44-L72 HydrophobicContact CE-CG 4.38Å; M44-L72 HydrophobicContact CG-CG 4.31Å; L47-L72 HydrophobicContact CB-CD1 3.3Å; L47-L72 HydrophobicContact CD1-CD1 3.95Å; L47-L72 HydrophobicContact CG-CD1 4.29Å; W55-L72 HydrophobicContact CH2-CB 4.23Å; W55-L72 HydrophobicContact CZ2-CD1 4.48Å; W55-L72 HydrophobicContact CZ3-CB 4.18Å; A68-L72 PolarHBondContact O-N 3.41Å; V69-L72 PolarHBondContact O-N 3.1Å; L72-R74 PolarHBondContact O-N 2.97Å; L72-R74 VanDerWaalsContact O-N 3.15Å; L72-S75 PolarHBondContact O-N 3.15Å; L72-S75 PolarHBondContact O-OG 3.06Å
73	L	96.6	Very high	95.6	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-29.8	177.4	-72.3	175.5	0	0	0	112.4	W55 V69 S75 V76 Y99 F100 H103 A104	W55-L73 HydrophobicContact CE3-CD2 3.75Å; W55-L73 HydrophobicContact CE3-CG 4.32Å; W55-L73 HydrophobicContact CZ3-CD2 3.93Å; V69-L73 HydrophobicContact CG1-CD1 3.86Å; V69-L73 HydrophobicContact CG1-CG 4.11Å; V69-L73 WeakPolarHBondContact O-CB 3.43Å; V69-L73 VanDerWaalsContact O-CG 3.26Å; V69-L73 WeakPolarHBondContact O-CG 3.28Å; V69-L73 PolarHBondContact O-N 3.04Å; L73-S75 PolarHBondContact O-N 3.32Å; L73-V76 HydrophobicContact CD2-CG2 4.36Å; L73-V76 WeakPolarHBondContact O-CB 3.43Å; L73-V76 PolarHBondContact O-N 3.27Å; L73-Y99 HydrophobicContact CD1-CE1 3.99Å; L73-F100 HydrophobicContact CD2-CD1 4.08Å; L73-F100 HydrophobicContact CD2-CD2 3.49Å; L73-F100 VanDerWaalsContact CD2-CD2 3.49Å; L73-F100 HydrophobicContact CD2-CE1 3.8Å; L73-F100 HydrophobicContact CD2-CE2 3.19Å; L73-F100 HydrophobicContact CD2-CG 3.93Å; L73-F100 HydrophobicContact CD2-CZ 3.35Å; L73-H103 HydrophobicContact CB-CB 3.88Å; L73-H103 HydrophobicContact CD1-CB 3.86Å; L73-A104 HydrophobicContact CB-CB 4.44Å; L73-A104 WeakPolarHBondContact O-CA 3.48Å; L73-A104 WeakPolarHBondContact O-CB 3.47Å
74	R	96.3	Very high	95.5	Very high	139 Å²	139	50.6 Å²	50.6	53%	0.525	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.2	174.8	-69	170.1	-174.6	-179.2	1.1	113.1	S70 L71 L72 H103 N106	S70-R74 WeakPolarHBondContact O-CG 3.41Å; S70-R74 PolarHBondContact O-N 3.26Å; L71-R74 WeakPolarHBondContact O-CB 3.47Å; L71-R74 PolarHBondContact O-N 2.95Å; L72-R74 PolarHBondContact O-N 2.97Å; L72-R74 VanDerWaalsContact O-N 3.15Å; R74-H103 WeakPolarHBondContact CG-O 3.4Å; R74-N106 WeakPolarHBondContact O-CB 3.48Å; R74-N106 PolarHBondContact O-ND2 2.96Å
75	S	95.7	Very high	95.2	Very high	81 Å²	81	47.5 Å²	47.5	57%	0.566	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-12.8	177.1	70.9	0	0	0	0	113.1	L72 L73 R77	L72-S75 PolarHBondContact O-N 3.15Å; L72-S75 PolarHBondContact O-OG 3.06Å; L73-S75 PolarHBondContact O-N 3.32Å; S75-R77 PolarHBondContact O-N 3.27Å
76	V	96.4	Very high	94.4	Very high	11 Å²	11	53.9 Å²	53.9	7%	0.067	25%	0.253	C	S	.	.			trans	-67.7	130.5	-179.1	-177.4	0	0	0	0	110.5	W55 L73 V78 V79 F100 N106 L107	W55-V76 HydrophobicContact CH2-CG2 4.21Å; W55-V76 HydrophobicContact CZ3-CG2 3.76Å; L73-V76 HydrophobicContact CD2-CG2 4.36Å; L73-V76 WeakPolarHBondContact O-CB 3.43Å; L73-V76 PolarHBondContact O-N 3.27Å; V76-V78 WeakPolarHBondContact CG1-O 3.3Å; V76-V79 HydrophobicContact CG1-CB 4.5Å; V76-F100 HydrophobicContact CG1-CE1 4.33Å; V76-F100 HydrophobicContact CG1-CZ 4.2Å; V76-F100 HydrophobicContact CG2-CZ 4.47Å; V76-N106 CarbonylContact O-C 3.46Å; V76-L107 HydrophobicContact CG1-CD2 3.84Å
77	R	97.7	Very high	93.2	Very high	149 Å²	149	55.6 Å²	55.6	56%	0.562	28%	0.275	S	S	*	.			trans	-113.6	-27.5	179.5	-62.5	-177.3	-176.9	179.1	1.3	113.4	S75 R108 E109	S75-R77 PolarHBondContact O-N 3.27Å; R77-R108 PolarHBondContact O-N 2.94Å; R77-E109 PolarHBondContact O-N 3.37Å
78	V	97.4	Very high	92.1	Very high	75 Å²	75	55.4 Å²	55.4	46%	0.455	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	130	-177.6	178.6	0	0	0	0	106.9	V76 E109	V76-V78 WeakPolarHBondContact CG1-O 3.3Å; V78-E109 WeakPolarHBondContact CA-O 3.36Å; V78-E109 HydrophobicContact CB-CB 4.32Å; V78-E109 HydrophobicContact CG1-CB 4.04Å; V78-E109 HydrophobicContact CG2-CB 4.06Å; V78-E109 HydrophobicContact CG2-CG 4.02Å
79	V	96.7	Very high	91.1	Very high	3 Å²	3	65.5 Å²	65.5	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.4	175.4	70.6	0	0	0	0	110.3	V76 F81 I84 F100 L107 E109 L110 T111	V76-V79 HydrophobicContact CG1-CB 4.5Å; V79-F81 HydrophobicContact CG1-CD2 4.32Å; V79-F81 HydrophobicContact CG1-CE2 3.86Å; V79-F81 HydrophobicContact CG2-CD2 4.21Å; V79-F81 HydrophobicContact CG2-CE1 4.44Å; V79-F81 HydrophobicContact CG2-CE2 4Å; V79-F81 HydrophobicContact CG2-CZ 4.13Å; V79-I84 HydrophobicContact CG2-CD1 3.46Å; V79-I84 VanDerWaalsContact CG2-CD1 3.46Å; V79-F100 HydrophobicContact CB-CE1 4Å; V79-F100 HydrophobicContact CB-CZ 4.26Å; V79-F100 HydrophobicContact CG1-CE1 4.35Å; V79-F100 HydrophobicContact CG2-CD1 4.3Å; V79-F100 HydrophobicContact CG2-CE1 3.57Å; V79-F100 HydrophobicContact CG2-CE2 4.27Å; V79-F100 HydrophobicContact CG2-CZ 3.55Å; V79-L107 HydrophobicContact CB-CD2 3.93Å; V79-L107 HydrophobicContact CG1-CD1 3.86Å; V79-L107 HydrophobicContact CG1-CD2 3.68Å; V79-L107 HydrophobicContact CG1-CG 4.43Å; V79-E109 PolarHBondContact N-O 3.21Å; V79-L110 HydrophobicContact CG1-CB 4.44Å; V79-L110 HydrophobicContact CG1-CD1 3.42Å; V79-L110 VanDerWaalsContact CG1-CD1 3.42Å; V79-T111 PolarHBondContact O-N 3.39Å
80	D	96.3	Very high	90.3	Very high	34 Å²	34	67.2 Å²	67.2	18%	0.182	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	104.3	171.3	176.8	-3.9	0	0	0	108	E82 R83 I84	D80-E82 PolarHBondContact O-N 3.1Å; D80-E82 WeakPolarHBondContact OD1-CB 3.45Å; D80-E82 PolarHBondContact OD1-N 2.73Å; D80-R83 HydrophobicContact CB-CG 4.37Å; D80-R83 PolarHBondContact O-N 3.1Å; D80-R83 WeakPolarHBondContact OD2-CD 3.38Å; D80-R83 WeakPolarHBondContact OD2-CG 3.38Å; D80-R83 IonicContact OD2-CZ 2.88Å; D80-R83 IonicContact OD2-NE 2.7Å; D80-R83 PolarHBondContact OD2-NE 2.96Å; D80-I84 WeakPolarHBondContact O-CG1 3.36Å; D80-I84 PolarHBondContact O-N 3.44Å
81	F	95.8	Very high	89.5	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-71.3	-17	-176.9	-75.8	-81.4	0	0	0	113.1	V79 R83 I84 V85 F96 V97 F100 L101 L110 T111 I112 V116	V79-F81 HydrophobicContact CG1-CD2 4.32Å; V79-F81 HydrophobicContact CG1-CE2 3.86Å; V79-F81 HydrophobicContact CG2-CD2 4.21Å; V79-F81 HydrophobicContact CG2-CE1 4.44Å; V79-F81 HydrophobicContact CG2-CE2 4Å; V79-F81 HydrophobicContact CG2-CZ 4.13Å; F81-R83 VanDerWaalsContact C-N 3.26Å; F81-R83 PolarHBondContact O-N 3.24Å; F81-I84 PolarHBondContact O-N 3.45Å; F81-V85 HydrophobicContact CB-CG2 4.3Å; F81-V85 HydrophobicContact CD1-CG2 3.88Å; F81-V85 WeakPolarHBondContact O-CB 3.4Å; F81-V85 PolarHBondContact O-N 2.71Å; F81-F96 AromaticContact CD1-CD1 3.89Å; F81-F96 HydrophobicContact CD1-CD1 3.89Å; F81-F96 AromaticContact CD1-CE1 3.62Å; F81-F96 HydrophobicContact CD1-CE1 3.62Å; F81-F96 AromaticContact CE1-CD1 3.68Å; F81-F96 HydrophobicContact CE1-CD1 3.68Å; F81-F96 AromaticContact CE1-CE1 3.45Å; F81-F96 HydrophobicContact CE1-CE1 3.45Å; F81-F96 VanDerWaalsContact CE1-CE1 3.45Å; F81-V97 HydrophobicContact CD1-CG2 3.68Å; F81-V97 HydrophobicContact CD2-CG2 4.39Å; F81-V97 HydrophobicContact CE1-CB 4.23Å; F81-V97 HydrophobicContact CE1-CG1 4.46Å; F81-V97 HydrophobicContact CE1-CG2 3.75Å; F81-V97 HydrophobicContact CE2-CG1 4.13Å; F81-V97 HydrophobicContact CE2-CG2 4.44Å; F81-V97 HydrophobicContact CG-CG2 4.02Å; F81-V97 HydrophobicContact CZ-CB 4.28Å; F81-V97 HydrophobicContact CZ-CG1 4.04Å; F81-V97 HydrophobicContact CZ-CG2 4.14Å; F81-F100 HydrophobicContact CE1-CB 3.91Å; F81-F100 HydrophobicContact CE1-CD1 4.31Å; F81-F100 HydrophobicContact CE1-CD2 4.2Å; F81-F100 AromaticContact CE1-CG 3.9Å; F81-F100 HydrophobicContact CE1-CG 3.9Å; F81-F100 HydrophobicContact CZ-CB 3.82Å; F81-F100 AromaticContact CZ-CD1 3.77Å; F81-F100 HydrophobicContact CZ-CD1 3.77Å; F81-F100 HydrophobicContact CZ-CD2 4.47Å; F81-F100 HydrophobicContact CZ-CE1 4.48Å; F81-F100 AromaticContact CZ-CG 3.77Å; F81-F100 HydrophobicContact CZ-CG 3.77Å; F81-L101 HydrophobicContact CE2-CD2 4.08Å; F81-L101 HydrophobicContact CZ-CD2 4.23Å; F81-L101 HydrophobicContact CZ-CG 4.41Å; F81-L110 HydrophobicContact CD2-CD1 3.87Å; F81-L110 HydrophobicContact CE2-CD1 3.52Å; F81-T111 PolarHBondContact N-O 2.92Å; F81-I112 HydrophobicContact CD2-CG1 3.76Å; F81-I112 HydrophobicContact CE2-CG1 4.24Å; F81-V116 HydrophobicContact CB-CG1 4.13Å; F81-V116 HydrophobicContact CB-CG2 4.3Å; F81-V116 WeakPolarHBondContact O-CG2 3.46Å
82	E	92.8	Very high	89	Confident	80 Å²	80	78.1 Å²	78.1	37%	0.374	38%	0.381	S	S	.	.	H	α-helix	trans	-66.5	-34.6	174.9	-175.2	160.5	-124	0	0	111	D80 H86 H113 S115 V116	D80-E82 PolarHBondContact O-N 3.1Å; D80-E82 WeakPolarHBondContact OD1-CB 3.45Å; D80-E82 PolarHBondContact OD1-N 2.73Å; E82-H86 PolarHBondContact O-CE1 2.73Å; E82-H86 PolarHBondContact O-ND1 2.92Å; E82-H113 HydrophobicContact CB-CB 4.47Å; E82-H113 IonicContact OE1-CE1 2.76Å; E82-H113 IonicContact OE1-CG 3.65Å; E82-H113 IonicContact OE1-ND1 3.19Å; E82-H113 PolarHBondContact OE1-ND1 2.7Å; E82-H113 VanDerWaalsContact OE1-ND1 3.12Å; E82-S115 PolarHBondContact OE1-OG 3.37Å; E82-V116 HydrophobicContact CB-CG2 4.18Å
83	R	91.1	Very high	88.8	Confident	179 Å²	179	77.5 Å²	77.5	68%	0.675	38%	0.377	S	S	*	.	H	α-helix	trans	-76.2	-27	174.7	-62.4	179.7	-168.2	-150.6	-6.1	113.7	D80 F81 H86	D80-R83 HydrophobicContact CB-CG 4.37Å; D80-R83 PolarHBondContact O-N 3.1Å; D80-R83 WeakPolarHBondContact OD2-CD 3.38Å; D80-R83 WeakPolarHBondContact OD2-CG 3.38Å; D80-R83 IonicContact OD2-CZ 2.88Å; D80-R83 IonicContact OD2-NE 2.7Å; D80-R83 PolarHBondContact OD2-NE 2.96Å; F81-R83 VanDerWaalsContact C-N 3.26Å; F81-R83 PolarHBondContact O-N 3.24Å; R83-H86 VanDerWaalsContact CA-CE1 3.49Å; R83-H86 WeakPolarHBondContact CA-CE1 3.39Å; R83-H86 PolarHBondContact O-CE1 3.21Å; R83-H86 PolarHBondContact O-NE2 3.01Å; R83-H86 VanDerWaalsContact O-NE2 3.14Å
84	I	90.5	Very high	88.7	Confident	15 Å²	15	78.6 Å²	78.6	8%	0.077	38%	0.383	C	S	.	.	H	α-helix	trans	-95.7	-30.3	-173.4	-58.6	168.4	0	0	0	111.6	Q52 T53 V79 D80 F81 F96 F100	Q52-I84 HydrophobicContact CB-CD1 4.29Å; Q52-I84 HydrophobicContact CB-CG1 4.29Å; Q52-I84 VanDerWaalsContact OE1-CD1 3.31Å; T53-I84 HydrophobicContact CG2-CG2 4.34Å; T53-I84 VanDerWaalsContact CG2-O 3.31Å; T53-I84 WeakPolarHBondContact CG2-O 3.46Å; V79-I84 HydrophobicContact CG2-CD1 3.46Å; V79-I84 VanDerWaalsContact CG2-CD1 3.46Å; D80-I84 WeakPolarHBondContact O-CG1 3.36Å; D80-I84 PolarHBondContact O-N 3.44Å; F81-I84 PolarHBondContact O-N 3.45Å; I84-F96 HydrophobicContact CG2-CE1 3.78Å; I84-F96 HydrophobicContact CG2-CE2 4.38Å; I84-F96 HydrophobicContact CG2-CZ 3.36Å; I84-F100 HydrophobicContact CD1-CE2 4.47Å
85	V	87.8	Confident	88.4	Confident	14 Å²	14	72.6 Å²	72.6	9%	0.085	36%	0.364	C	S	.	.			trans	-114.2	59.9	-172.5	-166.3	0	0	0	0	109.8	F81 S87 S88 A93 F96 V116	F81-V85 HydrophobicContact CB-CG2 4.3Å; F81-V85 HydrophobicContact CD1-CG2 3.88Å; F81-V85 WeakPolarHBondContact O-CB 3.4Å; F81-V85 PolarHBondContact O-N 2.71Å; V85-S87 VanDerWaalsContact C-N 3.31Å; V85-S87 PolarHBondContact O-N 3.06Å; V85-S88 WeakPolarHBondContact CG1-O 3.48Å; V85-A93 HydrophobicContact CG1-CB 4Å; V85-F96 HydrophobicContact CG2-CD1 3.64Å; V85-F96 HydrophobicContact CG2-CE1 3.6Å; V85-F96 HydrophobicContact CG2-CG 4.33Å; V85-F96 HydrophobicContact CG2-CZ 4.22Å; V85-V116 HydrophobicContact CB-CG1 3.89Å; V85-V116 HydrophobicContact CG1-CG1 4.11Å; V85-V116 HydrophobicContact CG2-CG1 4.21Å
86	H	77.7	Confident	88.2	Confident	144 Å²	144	70.2 Å²	70.2	67%	0.667	34%	0.343	S	S	*	.	S	Bend	trans	-67.3	-26	-178.4	-70.8	-36.1	0	0	0	114.4	E82 R83	E82-H86 PolarHBondContact O-CE1 2.73Å; E82-H86 PolarHBondContact O-ND1 2.92Å; R83-H86 VanDerWaalsContact CA-CE1 3.49Å; R83-H86 WeakPolarHBondContact CA-CE1 3.39Å; R83-H86 PolarHBondContact O-CE1 3.21Å; R83-H86 PolarHBondContact O-NE2 3.01Å; R83-H86 VanDerWaalsContact O-NE2 3.14Å
87	S	69.8	Low	88.2	Confident	106 Å²	106	69.7 Å²	69.7	74%	0.741	34%	0.34	S	S	*	.	S	Bend	trans	-120.6	-8	-166.1	-39.6	0	0	0	0	115.6	V85	V85-S87 VanDerWaalsContact C-N 3.31Å; V85-S87 PolarHBondContact O-N 3.06Å
88	S	72.2	Confident	88.1	Confident	51 Å²	51	63.6 Å²	63.6	36%	0.357	32%	0.32	S	S	.	.			trans	-111.1	111.1	-175.9	-61.7	0	0	0	0	109.5	V85 A93	V85-S88 WeakPolarHBondContact CG1-O 3.48Å; S88-A93 WeakPolarHBondContact O-CB 3.43Å
89	R	75.2	Confident	88	Confident	213 Å²	213	61.3 Å²	61.3	80%	0.804	30%	0.303	S	S	*	.			trans	-100.3	150.2	171.4	-66.9	-176.1	179.6	175.3	0.7	110.6
90	G	80.1	Confident	88	Confident	36 Å²	36	61.2 Å²	61.2	37%	0.371	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-136.3	171.7	0	0	0	0	0	114.4	K92 A93 E94	G90-K92 VanDerWaalsContact C-N 3.3Å; G90-K92 PolarHBondContact O-N 2.79Å; G90-A93 WeakPolarHBondContact O-CB 3.06Å; G90-A93 PolarHBondContact O-N 3.12Å; G90-A93 VanDerWaalsContact O-N 3.08Å; G90-E94 PolarHBondContact O-N 3.45Å
91	L	80.1	Confident	88	Confident	125 Å²	125	59.6 Å²	59.6	65%	0.654	29%	0.294	S	S	*	.	H	α-helix	trans	-60.6	-32.7	-167.8	-63	178.3	0	0	0	114.4	E94 G95	L91-E94 PolarHBondContact O-N 3.18Å; L91-G95 PolarHBondContact O-N 3.09Å
92	K	87	Confident	88.1	Confident	172 Å²	172	61.1 Å²	61.1	75%	0.748	30%	0.304	S	S	*	.	H	α-helix	trans	-66.5	-39.9	177.4	-70.8	-174.9	179.6	179.6	0	111.5	G90 E94 G95 F96	G90-K92 VanDerWaalsContact C-N 3.3Å; G90-K92 PolarHBondContact O-N 2.79Å; K92-E94 VanDerWaalsContact C-N 3.3Å; K92-E94 PolarHBondContact O-N 3Å; K92-G95 PolarHBondContact O-N 2.76Å; K92-F96 PolarHBondContact O-N 3.39Å
93	A	90.8	Very high	88.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-36.6	174.5	0	0	0	0	0	111.5	V85 S88 G90 G95 F96 V97 V116 L117	V85-A93 HydrophobicContact CG1-CB 4Å; S88-A93 WeakPolarHBondContact O-CB 3.43Å; G90-A93 WeakPolarHBondContact O-CB 3.06Å; G90-A93 PolarHBondContact O-N 3.12Å; G90-A93 VanDerWaalsContact O-N 3.08Å; A93-G95 PolarHBondContact O-N 2.67Å; A93-F96 WeakPolarHBondContact O-CB 3.37Å; A93-F96 PolarHBondContact O-N 2.79Å; A93-V97 WeakPolarHBondContact O-CB 3.31Å; A93-V97 VanDerWaalsContact O-CG2 3.26Å; A93-V97 WeakPolarHBondContact O-CG2 3.29Å; A93-V97 PolarHBondContact O-N 3.44Å; A93-V116 HydrophobicContact CB-CG1 4.2Å; A93-L117 HydrophobicContact CB-CD2 3.69Å
94	E	94.3	Very high	88.6	Confident	24 Å²	24	51.1 Å²	51.1	11%	0.112	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-44	179.9	-172.4	-180	96.2	0	0	112.1	G90 L91 K92 F96 V97 T98 L117 R121 V124	G90-E94 PolarHBondContact O-N 3.45Å; L91-E94 PolarHBondContact O-N 3.18Å; K92-E94 VanDerWaalsContact C-N 3.3Å; K92-E94 PolarHBondContact O-N 3Å; E94-F96 VanDerWaalsContact C-N 3.32Å; E94-F96 PolarHBondContact O-N 2.97Å; E94-V97 PolarHBondContact O-N 3.2Å; E94-T98 VanDerWaalsContact O-CB 3.29Å; E94-T98 WeakPolarHBondContact O-CB 3.05Å; E94-T98 PolarHBondContact O-N 2.97Å; E94-T98 PolarHBondContact O-OG1 2.94Å; E94-L117 HydrophobicContact CB-CD2 4.12Å; E94-R121 IonicContact OE1-CZ 3.29Å; E94-R121 IonicContact OE1-NE 2.92Å; E94-R121 IonicContact OE1-NH2 3.47Å; E94-R121 PolarHBondContact OE1-NH2 3.27Å; E94-R121 IonicContact OE2-CZ 3.1Å; E94-R121 IonicContact OE2-NE 2.66Å; E94-R121 PolarHBondContact OE2-NE 3.35Å; E94-R121 IonicContact OE2-NH2 3.28Å; E94-R121 PolarHBondContact OE2-NH2 3.29Å; E94-V124 HydrophobicContact CG-CG2 3.56Å
95	G	92	Very high	88.9	Confident	12 Å²	12	53.4 Å²	53.4	12%	0.124	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-43.2	176.3	0	0	0	0	0	112.4	Y16 L91 K92 A93 Y99	Y16-G95 WeakPolarHBondContact OH-CA 3.43Å; L91-G95 PolarHBondContact O-N 3.09Å; K92-G95 PolarHBondContact O-N 2.76Å; A93-G95 PolarHBondContact O-N 2.67Å; G95-Y99 WeakPolarHBondContact O-CB 3.18Å; G95-Y99 PolarHBondContact O-N 2.72Å
96	F	91.5	Very high	89.4	Confident	31 Å²	31	55.3 Å²	55.3	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-54.4	174.5	179.2	-79.2	0	0	0	111.6	V56 F81 I84 V85 K92 A93 E94 T98 Y99 F100	V56-F96 HydrophobicContact CB-CD2 3.45Å; V56-F96 VanDerWaalsContact CB-CD2 3.45Å; V56-F96 HydrophobicContact CB-CE2 3.21Å; V56-F96 HydrophobicContact CB-CZ 4.12Å; V56-F96 HydrophobicContact CG1-CD2 3.47Å; V56-F96 VanDerWaalsContact CG1-CD2 3.47Å; V56-F96 HydrophobicContact CG1-CE2 3.83Å; V56-F96 HydrophobicContact CG1-CG 4.38Å; V56-F96 HydrophobicContact CG2-CD2 3.43Å; V56-F96 VanDerWaalsContact CG2-CD2 3.43Å; V56-F96 HydrophobicContact CG2-CE1 4.27Å; V56-F96 HydrophobicContact CG2-CE2 3.03Å; V56-F96 HydrophobicContact CG2-CG 4.21Å; V56-F96 HydrophobicContact CG2-CZ 3.44Å; V56-F96 VanDerWaalsContact CG2-CZ 3.44Å; F81-F96 AromaticContact CD1-CD1 3.89Å; F81-F96 HydrophobicContact CD1-CD1 3.89Å; F81-F96 AromaticContact CD1-CE1 3.62Å; F81-F96 HydrophobicContact CD1-CE1 3.62Å; F81-F96 AromaticContact CE1-CD1 3.68Å; F81-F96 HydrophobicContact CE1-CD1 3.68Å; F81-F96 AromaticContact CE1-CE1 3.45Å; F81-F96 HydrophobicContact CE1-CE1 3.45Å; F81-F96 VanDerWaalsContact CE1-CE1 3.45Å; I84-F96 HydrophobicContact CG2-CE1 3.78Å; I84-F96 HydrophobicContact CG2-CE2 4.38Å; I84-F96 HydrophobicContact CG2-CZ 3.36Å; V85-F96 HydrophobicContact CG2-CD1 3.64Å; V85-F96 HydrophobicContact CG2-CE1 3.6Å; V85-F96 HydrophobicContact CG2-CG 4.33Å; V85-F96 HydrophobicContact CG2-CZ 4.22Å; K92-F96 PolarHBondContact O-N 3.39Å; A93-F96 WeakPolarHBondContact O-CB 3.37Å; A93-F96 PolarHBondContact O-N 2.79Å; E94-F96 VanDerWaalsContact C-N 3.32Å; E94-F96 PolarHBondContact O-N 2.97Å; F96-T98 PolarHBondContact O-N 3.4Å; F96-Y99 PolarHBondContact O-N 2.93Å; F96-F100 HydrophobicContact CE1-CD2 4.24Å; F96-F100 HydrophobicContact CZ-CD2 4.46Å; F96-F100 WeakPolarHBondContact O-CB 3.29Å; F96-F100 PolarHBondContact O-N 3.16Å
97	V	95.5	Very high	90.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-46.7	-178.6	172.2	0	0	0	0	110.1	F81 A93 E94 Y99 F100 L101 I112 L117 V124	F81-V97 HydrophobicContact CD1-CG2 3.68Å; F81-V97 HydrophobicContact CD2-CG2 4.39Å; F81-V97 HydrophobicContact CE1-CB 4.23Å; F81-V97 HydrophobicContact CE1-CG1 4.46Å; F81-V97 HydrophobicContact CE1-CG2 3.75Å; F81-V97 HydrophobicContact CE2-CG1 4.13Å; F81-V97 HydrophobicContact CE2-CG2 4.44Å; F81-V97 HydrophobicContact CG-CG2 4.02Å; F81-V97 HydrophobicContact CZ-CB 4.28Å; F81-V97 HydrophobicContact CZ-CG1 4.04Å; F81-V97 HydrophobicContact CZ-CG2 4.14Å; A93-V97 WeakPolarHBondContact O-CB 3.31Å; A93-V97 VanDerWaalsContact O-CG2 3.26Å; A93-V97 WeakPolarHBondContact O-CG2 3.29Å; A93-V97 PolarHBondContact O-N 3.44Å; E94-V97 PolarHBondContact O-N 3.2Å; V97-Y99 PolarHBondContact O-N 3.03Å; V97-F100 PolarHBondContact O-N 2.97Å; V97-L101 HydrophobicContact CG1-CD1 3.79Å; V97-L101 HydrophobicContact CG1-CG 4.12Å; V97-L101 WeakPolarHBondContact O-CB 3.26Å; V97-L101 VanDerWaalsContact O-CG 3.26Å; V97-L101 WeakPolarHBondContact O-CG 3.43Å; V97-L101 PolarHBondContact O-N 3.28Å; V97-I112 HydrophobicContact CG1-CD1 3.96Å; V97-L117 HydrophobicContact CB-CD1 4.09Å; V97-L117 HydrophobicContact CG1-CD1 4.09Å; V97-L117 HydrophobicContact CG2-CD1 3.91Å; V97-L117 HydrophobicContact CG2-CG 4.37Å; V97-V124 HydrophobicContact CB-CG2 4.36Å; V97-V124 HydrophobicContact CG1-CG1 3.78Å; V97-V124 HydrophobicContact CG1-CG2 4.05Å
98	T	96.1	Very high	91.7	Very high	22 Å²	22	48.9 Å²	48.9	14%	0.135	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-47.1	178.1	-54.2	0	0	0	0	111.1	E94 F96 F100 S102 P123 V124 E127	E94-T98 VanDerWaalsContact O-CB 3.29Å; E94-T98 WeakPolarHBondContact O-CB 3.05Å; E94-T98 PolarHBondContact O-N 2.97Å; E94-T98 PolarHBondContact O-OG1 2.94Å; F96-T98 PolarHBondContact O-N 3.4Å; T98-F100 PolarHBondContact O-N 3.22Å; T98-S102 VanDerWaalsContact O-CB 3.27Å; T98-S102 WeakPolarHBondContact O-CB 3.35Å; T98-S102 PolarHBondContact O-N 3.49Å; T98-S102 PolarHBondContact O-OG 3.43Å; T98-P123 HydrophobicContact CG2-CB 4.13Å; T98-V124 VanDerWaalsContact OG1-CG2 3.31Å; T98-V124 WeakPolarHBondContact OG1-CG2 3.47Å; T98-E127 HydrophobicContact CG2-CG 3.87Å
99	Y	94.8	Very high	93	Very high	27 Å²	27	50.2 Å²	50.2	11%	0.106	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-47.6	177.1	172.5	-96.2	0	0	0	111.5	V56 R66 V69 S70 L73 G95 F96 V97 S102 H103	V56-Y99 HydrophobicContact CG2-CD1 4.27Å; R66-Y99 HydrophobicContact CG-CE2 4.33Å; R66-Y99 WeakPolarHBondContact CG-OH 3.45Å; R66-Y99 PolarHBondContact O-OH 3.1Å; V69-Y99 HydrophobicContact CG1-CE1 4.34Å; S70-Y99 PolarHBondContact OG-OH 3.13Å; L73-Y99 HydrophobicContact CD1-CE1 3.99Å; G95-Y99 WeakPolarHBondContact O-CB 3.18Å; G95-Y99 PolarHBondContact O-N 2.72Å; F96-Y99 PolarHBondContact O-N 2.93Å; V97-Y99 PolarHBondContact O-N 3.03Å; Y99-S102 PolarHBondContact O-N 3.27Å; Y99-S102 PolarHBondContact O-OG 3.27Å; Y99-H103 AromaticContact CD2-CE1 3.6Å; Y99-H103 AromaticContact CD2-ND1 3.84Å; Y99-H103 AromaticContact CE2-CE1 3.29Å; Y99-H103 WeakPolarHBondContact CE2-CE1 3.43Å; Y99-H103 AromaticContact CE2-ND1 3.66Å; Y99-H103 AromaticContact CZ-CE1 3.89Å; Y99-H103 AromaticContact CZ-ND1 3.89Å; Y99-H103 PolarHBondContact O-ND1 3.07Å
100	F	96.2	Very high	94.1	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-60.2	-54.2	-179.4	-166.9	-70.1	0	0	0	111.3	L73 V76 V79 F81 I84 F96 V97 T98 S102 H103 A104	L73-F100 HydrophobicContact CD2-CD1 4.08Å; L73-F100 HydrophobicContact CD2-CD2 3.49Å; L73-F100 VanDerWaalsContact CD2-CD2 3.49Å; L73-F100 HydrophobicContact CD2-CE1 3.8Å; L73-F100 HydrophobicContact CD2-CE2 3.19Å; L73-F100 HydrophobicContact CD2-CG 3.93Å; L73-F100 HydrophobicContact CD2-CZ 3.35Å; V76-F100 HydrophobicContact CG1-CE1 4.33Å; V76-F100 HydrophobicContact CG1-CZ 4.2Å; V76-F100 HydrophobicContact CG2-CZ 4.47Å; V79-F100 HydrophobicContact CB-CE1 4Å; V79-F100 HydrophobicContact CB-CZ 4.26Å; V79-F100 HydrophobicContact CG1-CE1 4.35Å; V79-F100 HydrophobicContact CG2-CD1 4.3Å; V79-F100 HydrophobicContact CG2-CE1 3.57Å; V79-F100 HydrophobicContact CG2-CE2 4.27Å; V79-F100 HydrophobicContact CG2-CZ 3.55Å; F81-F100 HydrophobicContact CE1-CB 3.91Å; F81-F100 HydrophobicContact CE1-CD1 4.31Å; F81-F100 HydrophobicContact CE1-CD2 4.2Å; F81-F100 AromaticContact CE1-CG 3.9Å; F81-F100 HydrophobicContact CE1-CG 3.9Å; F81-F100 HydrophobicContact CZ-CB 3.82Å; F81-F100 AromaticContact CZ-CD1 3.77Å; F81-F100 HydrophobicContact CZ-CD1 3.77Å; F81-F100 HydrophobicContact CZ-CD2 4.47Å; F81-F100 HydrophobicContact CZ-CE1 4.48Å; F81-F100 AromaticContact CZ-CG 3.77Å; F81-F100 HydrophobicContact CZ-CG 3.77Å; I84-F100 HydrophobicContact CD1-CE2 4.47Å; F96-F100 HydrophobicContact CE1-CD2 4.24Å; F96-F100 HydrophobicContact CZ-CD2 4.46Å; F96-F100 WeakPolarHBondContact O-CB 3.29Å; F96-F100 PolarHBondContact O-N 3.16Å; V97-F100 PolarHBondContact O-N 2.97Å; T98-F100 PolarHBondContact O-N 3.22Å; F100-S102 PolarHBondContact O-N 2.89Å; F100-H103 PolarHBondContact O-N 2.94Å; F100-H103 VanDerWaalsContact O-N 3.1Å; F100-A104 HydrophobicContact CD1-CB 3.85Å; F100-A104 HydrophobicContact CE1-CB 3.76Å; F100-A104 WeakPolarHBondContact O-CB 3.5Å; F100-A104 PolarHBondContact O-N 2.67Å
101	L	97.5	Very high	94.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61	-30.7	179.4	-64.5	-176.1	0	0	0	112.2	F81 V97 H103 L107 L110 I112 V124 E127 M128 L131	F81-L101 HydrophobicContact CE2-CD2 4.08Å; F81-L101 HydrophobicContact CZ-CD2 4.23Å; F81-L101 HydrophobicContact CZ-CG 4.41Å; V97-L101 HydrophobicContact CG1-CD1 3.79Å; V97-L101 HydrophobicContact CG1-CG 4.12Å; V97-L101 WeakPolarHBondContact O-CB 3.26Å; V97-L101 VanDerWaalsContact O-CG 3.26Å; V97-L101 WeakPolarHBondContact O-CG 3.43Å; V97-L101 PolarHBondContact O-N 3.28Å; L101-H103 PolarHBondContact O-N 2.9Å; L101-L107 HydrophobicContact CD2-CD1 3.61Å; L101-L110 HydrophobicContact CD1-CD2 4.42Å; L101-L110 HydrophobicContact CD2-CD1 3.9Å; L101-L110 HydrophobicContact CD2-CD2 4.02Å; L101-I112 HydrophobicContact CD1-CD1 4.48Å; L101-V124 HydrophobicContact CD1-CG1 4.09Å; L101-E127 HydrophobicContact CB-CB 3.69Å; L101-E127 HydrophobicContact CD1-CB 4.37Å; L101-M128 HydrophobicContact CD1-CG 3.59Å; L101-L131 HydrophobicContact CD2-CD1 4.14Å
102	S	97.2	Very high	95.7	Very high	31 Å²	31	33.7 Å²	33.7	22%	0.217	16%	0.157	C	C	.	.	H	α-helix	trans	-67.9	-21.9	179.8	75.6	0	0	0	0	114	T98 Y99 F100 R105 E127	T98-S102 VanDerWaalsContact O-CB 3.27Å; T98-S102 WeakPolarHBondContact O-CB 3.35Å; T98-S102 PolarHBondContact O-N 3.49Å; T98-S102 PolarHBondContact O-OG 3.43Å; Y99-S102 PolarHBondContact O-N 3.27Å; Y99-S102 PolarHBondContact O-OG 3.27Å; F100-S102 PolarHBondContact O-N 2.89Å; S102-R105 VanDerWaalsContact CA-NH2 3.3Å; S102-R105 VanDerWaalsContact O-CZ 3.3Å; S102-R105 PolarHBondContact O-NE 3.38Å; S102-R105 PolarHBondContact O-NH2 3.01Å; S102-E127 WeakPolarHBondContact CA-OE2 3.46Å; S102-E127 WeakPolarHBondContact CB-OE2 3.37Å
103	H	97.4	Very high	96.1	Very high	49 Å²	49	27.7 Å²	27.7	23%	0.227	13%	0.132	C	C	.	.	H	α-helix	trans	-108.3	-25.9	179.1	-60.9	91.3	0	0	0	113.2	S70 L73 R74 Y99 F100 L101 R105	S70-H103 PolarHBondContact OG-CD2 3.45Å; S70-H103 VanDerWaalsContact OG-CD2 3.24Å; S70-H103 PolarHBondContact OG-NE2 2.84Å; L73-H103 HydrophobicContact CB-CB 3.88Å; L73-H103 HydrophobicContact CD1-CB 3.86Å; R74-H103 WeakPolarHBondContact CG-O 3.4Å; Y99-H103 AromaticContact CD2-CE1 3.6Å; Y99-H103 AromaticContact CD2-ND1 3.84Å; Y99-H103 AromaticContact CE2-CE1 3.29Å; Y99-H103 WeakPolarHBondContact CE2-CE1 3.43Å; Y99-H103 AromaticContact CE2-ND1 3.66Å; Y99-H103 AromaticContact CZ-CE1 3.89Å; Y99-H103 AromaticContact CZ-ND1 3.89Å; Y99-H103 PolarHBondContact O-ND1 3.07Å; F100-H103 PolarHBondContact O-N 2.94Å; F100-H103 VanDerWaalsContact O-N 3.1Å; L101-H103 PolarHBondContact O-N 2.9Å; H103-R105 VanDerWaalsContact C-N 3.33Å; H103-R105 PolarHBondContact O-N 2.75Å; H103-R105 VanDerWaalsContact O-N 3.1Å
104	A	97.2	Very high	96.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.139	C	C	.	.			trans	-86.7	60.2	-178.1	0	0	0	0	0	113.2	L73 F100 N106 L107	L73-A104 HydrophobicContact CB-CB 4.44Å; L73-A104 WeakPolarHBondContact O-CA 3.48Å; L73-A104 WeakPolarHBondContact O-CB 3.47Å; F100-A104 HydrophobicContact CD1-CB 3.85Å; F100-A104 HydrophobicContact CE1-CB 3.76Å; F100-A104 WeakPolarHBondContact O-CB 3.5Å; F100-A104 PolarHBondContact O-N 2.67Å; A104-N106 PolarHBondContact O-N 3.19Å; A104-L107 HydrophobicContact CB-CD1 3.76Å; A104-L107 HydrophobicContact CB-CD2 4.41Å; A104-L107 HydrophobicContact CB-CG 3.81Å; A104-L107 WeakPolarHBondContact O-CD1 3.5Å; A104-L107 VanDerWaalsContact O-CG 3.23Å; A104-L107 WeakPolarHBondContact O-CG 3.23Å; A104-L107 PolarHBondContact O-N 3.27Å
105	R	96.8	Very high	96.2	Very high	64 Å²	64	29.5 Å²	29.5	24%	0.242	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.2	-175.9	-59.4	-59.3	177.7	-175	-3.7	115.3	S102 H103 E127 D130	S102-R105 VanDerWaalsContact CA-NH2 3.3Å; S102-R105 VanDerWaalsContact O-CZ 3.3Å; S102-R105 PolarHBondContact O-NE 3.38Å; S102-R105 PolarHBondContact O-NH2 3.01Å; H103-R105 VanDerWaalsContact C-N 3.33Å; H103-R105 PolarHBondContact O-N 2.75Å; H103-R105 VanDerWaalsContact O-N 3.1Å; R105-E127 IonicContact CZ-OE2 3.7Å; R105-E127 VanDerWaalsContact CZ-OE2 3.29Å; R105-E127 PolarHBondContact NH1-O 3.12Å; R105-E127 IonicContact NH1-OE2 2.71Å; R105-E127 PolarHBondContact NH1-OE2 2.97Å; R105-E127 VanDerWaalsContact NH1-OE2 3.1Å; R105-E127 IonicContact NH2-OE2 4Å; R105-E127 PolarHBondContact NH2-OE2 3.41Å; R105-D130 IonicContact NH1-OD2 2.7Å
106	N	97.7	Very high	96.3	Very high	54 Å²	54	29.1 Å²	29.1	29%	0.289	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	11.3	179.7	-71.7	-41.7	0	0	0	113.6	R74 V76 A104 R108 R133	R74-N106 WeakPolarHBondContact O-CB 3.48Å; R74-N106 PolarHBondContact O-ND2 2.96Å; V76-N106 CarbonylContact O-C 3.46Å; A104-N106 PolarHBondContact O-N 3.19Å; N106-R108 PolarHBondContact O-N 2.8Å; N106-R133 PolarHBondContact OD1-NH1 2.76Å
107	L	98.3	Very high	96.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.			trans	-58.5	133.6	176.2	-74.3	172.8	0	0	0	111.3	V76 V79 L101 A104 L131 R133 L134	V76-L107 HydrophobicContact CG1-CD2 3.84Å; V79-L107 HydrophobicContact CB-CD2 3.93Å; V79-L107 HydrophobicContact CG1-CD1 3.86Å; V79-L107 HydrophobicContact CG1-CD2 3.68Å; V79-L107 HydrophobicContact CG1-CG 4.43Å; L101-L107 HydrophobicContact CD2-CD1 3.61Å; A104-L107 HydrophobicContact CB-CD1 3.76Å; A104-L107 HydrophobicContact CB-CD2 4.41Å; A104-L107 HydrophobicContact CB-CG 3.81Å; A104-L107 WeakPolarHBondContact O-CD1 3.5Å; A104-L107 VanDerWaalsContact O-CG 3.23Å; A104-L107 WeakPolarHBondContact O-CG 3.23Å; A104-L107 PolarHBondContact O-N 3.27Å; L107-L131 HydrophobicContact CD1-CD1 4.22Å; L107-L131 HydrophobicContact CD1-CD2 4.38Å; L107-R133 CarbonylContact O-C 3.54Å; L107-L134 HydrophobicContact CB-CD1 4.23Å; L107-L134 WeakPolarHBondContact O-CA 3.36Å; L107-L134 PolarHBondContact O-N 2.81Å
108	R	98.4	Very high	96.4	Very high	114 Å²	114	31.7 Å²	31.7	43%	0.43	17%	0.166	S	C	.	.	S	Bend	trans	-110.6	-30.9	171.7	-65.8	-173.2	177.1	-172.5	-3	111.2	R77 N106 R135 K136	R77-R108 PolarHBondContact O-N 2.94Å; N106-R108 PolarHBondContact O-N 2.8Å; R108-R135 PolarHBondContact O-N 3.07Å; R108-K136 PolarHBondContact O-N 2.9Å
109	E	98.6	Very high	96.3	Very high	80 Å²	80	32.8 Å²	32.8	37%	0.374	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.4	179.6	-50.8	-179.3	-153.9	0	0	109.9	R77 V78 V79 K136	R77-E109 PolarHBondContact O-N 3.37Å; V78-E109 WeakPolarHBondContact CA-O 3.36Å; V78-E109 HydrophobicContact CB-CB 4.32Å; V78-E109 HydrophobicContact CG1-CB 4.04Å; V78-E109 HydrophobicContact CG2-CB 4.06Å; V78-E109 HydrophobicContact CG2-CG 4.02Å; V79-E109 PolarHBondContact N-O 3.21Å; E109-K136 WeakPolarHBondContact CA-O 3.39Å; E109-K136 HydrophobicContact CB-CB 4.09Å; E109-K136 HydrophobicContact CB-CD 4.24Å; E109-K136 HydrophobicContact CB-CG 4.46Å; E109-K136 HydrophobicContact CG-CB 3.91Å; E109-K136 HydrophobicContact CG-CD 4.13Å
110	L	98.4	Very high	96.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	117.8	-177.8	170.7	58.7	0	0	0	109.7	V79 F81 L101 I112 M128 L131 L134 K136 L137 D138	V79-L110 HydrophobicContact CG1-CB 4.44Å; V79-L110 HydrophobicContact CG1-CD1 3.42Å; V79-L110 VanDerWaalsContact CG1-CD1 3.42Å; F81-L110 HydrophobicContact CD2-CD1 3.87Å; F81-L110 HydrophobicContact CE2-CD1 3.52Å; L101-L110 HydrophobicContact CD1-CD2 4.42Å; L101-L110 HydrophobicContact CD2-CD1 3.9Å; L101-L110 HydrophobicContact CD2-CD2 4.02Å; L110-I112 HydrophobicContact CD1-CD1 4.03Å; L110-I112 HydrophobicContact CD1-CG1 3.72Å; L110-I112 HydrophobicContact CD2-CD1 4.16Å; L110-I112 HydrophobicContact CG-CD1 4.26Å; L110-I112 HydrophobicContact CG-CG1 4.13Å; L110-M128 HydrophobicContact CD2-CE 4.07Å; L110-M128 HydrophobicContact CD2-CG 4.06Å; L110-L131 HydrophobicContact CD2-CD1 3.83Å; L110-L134 HydrophobicContact CB-CD1 3.54Å; L110-L134 HydrophobicContact CB-CD2 4.24Å; L110-L134 HydrophobicContact CD2-CD2 4.3Å; L110-K136 PolarHBondContact N-O 3.19Å; L110-L137 HydrophobicContact CB-CD1 4.32Å; L110-L137 HydrophobicContact CD2-CD1 3.97Å; L110-L137 HydrophobicContact CG-CD1 4.09Å; L110-D138 PolarHBondContact O-N 3.12Å
111	T	98	Very high	96.3	Very high	26 Å²	26	37.1 Å²	37.1	16%	0.16	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.1	170.8	-61.5	0	0	0	0	110.3	V79 F81 D138	V79-T111 PolarHBondContact O-N 3.39Å; F81-T111 PolarHBondContact N-O 2.92Å; T111-D138 WeakPolarHBondContact CA-O 3.45Å; T111-D138 HydrophobicContact CG2-CB 4.06Å
112	I	96.8	Very high	96.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.			trans	-124.5	97.1	170.6	-55	174.1	0	0	0	106.4	F81 V97 L101 L110 L117 V124 M128 D138 V139 C142	F81-I112 HydrophobicContact CD2-CG1 3.76Å; F81-I112 HydrophobicContact CE2-CG1 4.24Å; V97-I112 HydrophobicContact CG1-CD1 3.96Å; L101-I112 HydrophobicContact CD1-CD1 4.48Å; L110-I112 HydrophobicContact CD1-CD1 4.03Å; L110-I112 HydrophobicContact CD1-CG1 3.72Å; L110-I112 HydrophobicContact CD2-CD1 4.16Å; L110-I112 HydrophobicContact CG-CD1 4.26Å; L110-I112 HydrophobicContact CG-CG1 4.13Å; I112-L117 HydrophobicContact CG2-CB 3.95Å; I112-L117 HydrophobicContact CG2-CD1 3.94Å; I112-L117 HydrophobicContact CG2-CG 4.12Å; I112-V124 HydrophobicContact CD1-CG1 4.18Å; I112-M128 HydrophobicContact CD1-CE 4.36Å; I112-M128 HydrophobicContact CD1-SD 4.14Å; I112-D138 PolarHBondContact N-O 2.68Å; I112-V139 WeakPolarHBondContact O-CA 3.16Å; I112-C142 PolarHBondContact O-SG 3.28Å
113	H	95.4	Very high	96.2	Very high	46 Å²	46	46.5 Å²	46.5	21%	0.213	23%	0.229	C	C	.	.			trans	-80.2	153.5	177.9	-172.5	-116.9	0	0	0	111.7	E82 S115 V116 L117 S140 F141	E82-H113 HydrophobicContact CB-CB 4.47Å; E82-H113 IonicContact OE1-CE1 2.76Å; E82-H113 IonicContact OE1-CG 3.65Å; E82-H113 IonicContact OE1-ND1 3.19Å; E82-H113 PolarHBondContact OE1-ND1 2.7Å; E82-H113 VanDerWaalsContact OE1-ND1 3.12Å; H113-S115 WeakPolarHBondContact ND1-CB 3.43Å; H113-S115 PolarHBondContact ND1-N 3.35Å; H113-S115 PolarHBondContact ND1-OG 2.94Å; H113-S115 PolarHBondContact O-N 2.85Å; H113-S115 VanDerWaalsContact O-N 3.08Å; H113-V116 WeakPolarHBondContact O-CB 3.34Å; H113-V116 PolarHBondContact O-N 3.38Å; H113-L117 PolarHBondContact O-N 3.47Å; H113-L117 VanDerWaalsContact O-N 3.17Å; H113-S140 PolarHBondContact CD2-O 3.16Å; H113-F141 AromaticContact CD2-CD2 3.77Å; H113-F141 AromaticContact NE2-CD2 3.2Å; H113-F141 WeakPolarHBondContact NE2-CD2 3.37Å; H113-F141 AromaticContact NE2-CE2 3.8Å
114	G	94.2	Very high	96.2	Very high	15 Å²	15	44.1 Å²	44.1	16%	0.155	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23	177.2	0	0	0	0	0	114.7	V116 L117 S118 S140 F141	G114-V116 VanDerWaalsContact C-N 3.28Å; G114-V116 PolarHBondContact O-N 3.43Å; G114-L117 CarbonylContact O-C 3.59Å; G114-S118 PolarHBondContact O-N 3.44Å; G114-S140 PolarHBondContact N-O 2.84Å; G114-F141 WeakPolarHBondContact CA-O 3.43Å
115	S	92.5	Very high	96.3	Very high	48 Å²	48	44.3 Å²	44.3	34%	0.336	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-30	173.1	65.8	0	0	0	0	112.9	E82 H113	E82-S115 PolarHBondContact OE1-OG 3.37Å; H113-S115 WeakPolarHBondContact ND1-CB 3.43Å; H113-S115 PolarHBondContact ND1-N 3.35Å; H113-S115 PolarHBondContact ND1-OG 2.94Å; H113-S115 PolarHBondContact O-N 2.85Å; H113-S115 VanDerWaalsContact O-N 3.08Å
116	V	93.7	Very high	96.3	Very high	3 Å²	3	44 Å²	44	2%	0.018	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-56.5	177	-176.6	0	0	0	0	110.4	F81 E82 V85 A93 H113 G114	F81-V116 HydrophobicContact CB-CG1 4.13Å; F81-V116 HydrophobicContact CB-CG2 4.3Å; F81-V116 WeakPolarHBondContact O-CG2 3.46Å; E82-V116 HydrophobicContact CB-CG2 4.18Å; V85-V116 HydrophobicContact CB-CG1 3.89Å; V85-V116 HydrophobicContact CG1-CG1 4.11Å; V85-V116 HydrophobicContact CG2-CG1 4.21Å; A93-V116 HydrophobicContact CB-CG1 4.2Å; H113-V116 WeakPolarHBondContact O-CB 3.34Å; H113-V116 PolarHBondContact O-N 3.38Å; G114-V116 VanDerWaalsContact C-N 3.28Å; G114-V116 PolarHBondContact O-N 3.43Å
117	L	94.7	Very high	96.3	Very high	6 Å²	6	43 Å²	43	3%	0.031	22%	0.216	C	C	.	.			trans	-126.7	104.3	179	-68.2	-175.6	0	0	0	110	A93 E94 V97 I112 H113 G114 S119 V124 C142	A93-L117 HydrophobicContact CB-CD2 3.69Å; E94-L117 HydrophobicContact CB-CD2 4.12Å; V97-L117 HydrophobicContact CB-CD1 4.09Å; V97-L117 HydrophobicContact CG1-CD1 4.09Å; V97-L117 HydrophobicContact CG2-CD1 3.91Å; V97-L117 HydrophobicContact CG2-CG 4.37Å; I112-L117 HydrophobicContact CG2-CB 3.95Å; I112-L117 HydrophobicContact CG2-CD1 3.94Å; I112-L117 HydrophobicContact CG2-CG 4.12Å; H113-L117 PolarHBondContact O-N 3.47Å; H113-L117 VanDerWaalsContact O-N 3.17Å; G114-L117 CarbonylContact O-C 3.59Å; L117-S119 PolarHBondContact O-N 2.78Å; L117-S119 VanDerWaalsContact O-N 3.11Å; L117-V124 HydrophobicContact CD1-CG1 4.4Å; L117-V124 HydrophobicContact CD1-CG2 4.11Å; L117-C142 PolarHBondContact O-SG 2.76Å
118	S	93.9	Very high	96.4	Very high	80 Å²	80	43 Å²	43	56%	0.559	22%	0.216	S	C	*	.	S	Bend	trans	-64.7	-16.5	176.3	60.4	0	0	0	0	113.7	G114 R143	G114-S118 PolarHBondContact O-N 3.44Å; S118-R143 WeakPolarHBondContact O-CB 3.22Å; S118-R143 WeakPolarHBondContact O-CG 3.34Å; S118-R143 PolarHBondContact O-N 3.41Å
119	S	94	Very high	96.3	Very high	44 Å²	44	39.1 Å²	39.1	31%	0.308	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-149.5	137.2	173	-177.2	0	0	0	0	112	L117 R143	L117-S119 PolarHBondContact O-N 2.78Å; L117-S119 VanDerWaalsContact O-N 3.11Å; S119-R143 CarbonylContact C-O 3.38Å; S119-R143 WeakPolarHBondContact CA-O 3.49Å; S119-R143 WeakPolarHBondContact CB-O 3.48Å; S119-R143 PolarHBondContact OG-O 2.75Å
120	I	95.9	Very high	96.3	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	20%	0.2	C	C	.	.			trans	-91.3	106.6	172.9	-67	161.9	0	0	0	108.7	V124 L125 M128 V139 C142 R143 I144	I120-V124 HydrophobicContact CG2-CB 4.25Å; I120-V124 HydrophobicContact CG2-CG1 4.04Å; I120-L125 HydrophobicContact CG2-CB 4.17Å; I120-L125 HydrophobicContact CG2-CD1 4.23Å; I120-M128 HydrophobicContact CD1-CE 4.39Å; I120-M128 HydrophobicContact CD1-SD 4.33Å; I120-M128 HydrophobicContact CG2-SD 3.93Å; I120-V139 HydrophobicContact CD1-CB 3.84Å; I120-V139 HydrophobicContact CD1-CG1 3.47Å; I120-V139 VanDerWaalsContact CD1-CG1 3.47Å; I120-C142 HydrophobicContact CD1-CB 3.68Å; I120-C142 HydrophobicContact CG1-CB 3.94Å; I120-R143 PolarHBondContact N-O 3.1Å; I120-I144 HydrophobicContact CB-CD1 4.26Å; I120-I144 HydrophobicContact CB-CG1 4.04Å; I120-I144 HydrophobicContact CD1-CD1 3.67Å; I120-I144 HydrophobicContact CD1-CG1 4.13Å; I120-I144 HydrophobicContact CG1-CD1 4.49Å
121	R	95.4	Very high	96.3	Very high	113 Å²	113	38.1 Å²	38.1	43%	0.426	20%	0.2	S	C	.	.			trans	-94.1	174.4	178.4	-60.1	-172.2	-60.7	172.3	9.8	111.4	E94 P123 V124 L125	E94-R121 IonicContact OE1-CZ 3.29Å; E94-R121 IonicContact OE1-NE 2.92Å; E94-R121 IonicContact OE1-NH2 3.47Å; E94-R121 PolarHBondContact OE1-NH2 3.27Å; E94-R121 IonicContact OE2-CZ 3.1Å; E94-R121 IonicContact OE2-NE 2.66Å; E94-R121 PolarHBondContact OE2-NE 3.35Å; E94-R121 IonicContact OE2-NH2 3.28Å; E94-R121 PolarHBondContact OE2-NH2 3.29Å; R121-P123 VanDerWaalsContact C-CD 3.42Å; R121-V124 PolarHBondContact O-N 3.37Å; R121-L125 WeakPolarHBondContact O-CB 3.42Å; R121-L125 PolarHBondContact O-N 3.15Å
122	R	96.3	Very high	96.2	Very high	176 Å²	176	44.2 Å²	44.2	66%	0.664	23%	0.227	S	C	*	.	H	α-helix	trans	-49.4	-42.4	-173.6	-169.9	177	-177.3	132.4	-1.4	115.2	N126	R122-N126 WeakPolarHBondContact O-CB 3.26Å; R122-N126 PolarHBondContact O-N 3.19Å; R122-N126 PolarHBondContact O-ND2 2.81Å; R122-N126 PolarHBondContact O-OD1 3.32Å
123	P	97	Very high	96.3	Very high	52 Å²	52	51.2 Å²	51.2	34%	0.338	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-53.2	-179.4	-24	35.4	0	0	0	112.4	T98 R121 L125 N126 E127	T98-P123 HydrophobicContact CG2-CB 4.13Å; R121-P123 VanDerWaalsContact C-CD 3.42Å; P123-L125 PolarHBondContact O-N 2.95Å; P123-N126 PolarHBondContact O-N 2.89Å; P123-E127 PolarHBondContact O-N 2.87Å
124	V	97.7	Very high	96.4	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-45.7	178	175.8	0	0	0	0	110.6	E94 V97 T98 L101 I112 L117 I120 R121 N126 E127 M128	E94-V124 HydrophobicContact CG-CG2 3.56Å; V97-V124 HydrophobicContact CB-CG2 4.36Å; V97-V124 HydrophobicContact CG1-CG1 3.78Å; V97-V124 HydrophobicContact CG1-CG2 4.05Å; T98-V124 VanDerWaalsContact OG1-CG2 3.31Å; T98-V124 WeakPolarHBondContact OG1-CG2 3.47Å; L101-V124 HydrophobicContact CD1-CG1 4.09Å; I112-V124 HydrophobicContact CD1-CG1 4.18Å; L117-V124 HydrophobicContact CD1-CG1 4.4Å; L117-V124 HydrophobicContact CD1-CG2 4.11Å; I120-V124 HydrophobicContact CG2-CB 4.25Å; I120-V124 HydrophobicContact CG2-CG1 4.04Å; R121-V124 PolarHBondContact O-N 3.37Å; V124-N126 VanDerWaalsContact C-N 3.32Å; V124-N126 PolarHBondContact O-N 3.17Å; V124-E127 PolarHBondContact O-N 3.35Å; V124-E127 VanDerWaalsContact O-N 3.1Å; V124-M128 HydrophobicContact CG1-CG 4.17Å; V124-M128 HydrophobicContact CG1-SD 3.72Å; V124-M128 VanDerWaalsContact O-CG 3.29Å; V124-M128 WeakPolarHBondContact O-CG 3.26Å; V124-M128 PolarHBondContact O-N 3.18Å
125	L	97.9	Very high	96.6	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-55.7	-43.2	178.1	-171.7	81.2	0	0	0	113	I120 R121 P123 E127 M128 I129 A148 L152	I120-L125 HydrophobicContact CG2-CB 4.17Å; I120-L125 HydrophobicContact CG2-CD1 4.23Å; R121-L125 WeakPolarHBondContact O-CB 3.42Å; R121-L125 PolarHBondContact O-N 3.15Å; P123-L125 PolarHBondContact O-N 2.95Å; L125-E127 VanDerWaalsContact C-N 3.33Å; L125-M128 PolarHBondContact O-N 3.22Å; L125-I129 HydrophobicContact CD2-CD1 4.49Å; L125-I129 HydrophobicContact CG-CD1 4.07Å; L125-I129 WeakPolarHBondContact O-CD1 3.4Å; L125-I129 VanDerWaalsContact O-CG1 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.44Å; L125-I129 PolarHBondContact O-N 3.45Å; L125-I129 VanDerWaalsContact O-N 3.1Å; L125-A148 HydrophobicContact CD1-CB 4.3Å; L125-A148 HydrophobicContact CD2-CB 3.63Å; L125-L152 HydrophobicContact CD1-CB 3.84Å; L125-L152 HydrophobicContact CD1-CD1 4.28Å; L125-L152 HydrophobicContact CD1-CD2 4.23Å; L125-L152 HydrophobicContact CD1-CG 4.35Å
126	N	98.1	Very high	96.9	Very high	57 Å²	57	54.1 Å²	54.1	31%	0.305	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-44.6	178.3	-65.9	-25.5	0	0	0	110.7	R122 P123 V124 I129 D130 R151	R122-N126 WeakPolarHBondContact O-CB 3.26Å; R122-N126 PolarHBondContact O-N 3.19Å; R122-N126 PolarHBondContact O-ND2 2.81Å; R122-N126 PolarHBondContact O-OD1 3.32Å; P123-N126 PolarHBondContact O-N 2.89Å; V124-N126 VanDerWaalsContact C-N 3.32Å; V124-N126 PolarHBondContact O-N 3.17Å; N126-I129 PolarHBondContact O-N 2.83Å; N126-D130 PolarHBondContact O-N 3.22Å; N126-R151 PolarHBondContact OD1-NH2 3.32Å
127	E	98.2	Very high	97.2	Very high	34 Å²	34	54 Å²	54	16%	0.159	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-35.7	-178.8	-61.2	-56.1	151.8	0	0	112.1	T98 L101 S102 R105 P123 V124 L125 D130	T98-E127 HydrophobicContact CG2-CG 3.87Å; L101-E127 HydrophobicContact CB-CB 3.69Å; L101-E127 HydrophobicContact CD1-CB 4.37Å; S102-E127 WeakPolarHBondContact CA-OE2 3.46Å; S102-E127 WeakPolarHBondContact CB-OE2 3.37Å; R105-E127 IonicContact CZ-OE2 3.7Å; R105-E127 VanDerWaalsContact CZ-OE2 3.29Å; R105-E127 PolarHBondContact NH1-O 3.12Å; R105-E127 IonicContact NH1-OE2 2.71Å; R105-E127 PolarHBondContact NH1-OE2 2.97Å; R105-E127 VanDerWaalsContact NH1-OE2 3.1Å; R105-E127 IonicContact NH2-OE2 4Å; R105-E127 PolarHBondContact NH2-OE2 3.41Å; P123-E127 PolarHBondContact O-N 2.87Å; V124-E127 PolarHBondContact O-N 3.35Å; V124-E127 VanDerWaalsContact O-N 3.1Å; L125-E127 VanDerWaalsContact C-N 3.33Å; E127-D130 PolarHBondContact O-N 2.84Å
128	M	98.6	Very high	97.3	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-42.4	175.2	-67.4	170.5	75	0	0	112.6	L101 L110 I112 I120 V124 L125 D130 L131 L137 V139 L152	L101-M128 HydrophobicContact CD1-CG 3.59Å; L110-M128 HydrophobicContact CD2-CE 4.07Å; L110-M128 HydrophobicContact CD2-CG 4.06Å; I112-M128 HydrophobicContact CD1-CE 4.36Å; I112-M128 HydrophobicContact CD1-SD 4.14Å; I120-M128 HydrophobicContact CD1-CE 4.39Å; I120-M128 HydrophobicContact CD1-SD 4.33Å; I120-M128 HydrophobicContact CG2-SD 3.93Å; V124-M128 HydrophobicContact CG1-CG 4.17Å; V124-M128 HydrophobicContact CG1-SD 3.72Å; V124-M128 VanDerWaalsContact O-CG 3.29Å; V124-M128 WeakPolarHBondContact O-CG 3.26Å; V124-M128 PolarHBondContact O-N 3.18Å; L125-M128 PolarHBondContact O-N 3.22Å; M128-D130 PolarHBondContact O-N 2.93Å; M128-L131 VanDerWaalsContact O-CB 3.31Å; M128-L131 WeakPolarHBondContact O-CB 3.22Å; M128-L131 WeakPolarHBondContact O-CG 3.37Å; M128-L131 PolarHBondContact O-N 3.25Å; M128-L137 HydrophobicContact CE-CD1 3.49Å; M128-L137 VanDerWaalsContact CE-CD1 3.49Å; M128-L137 HydrophobicContact CE-CD2 4.16Å; M128-L137 HydrophobicContact CE-CG 4.45Å; M128-V139 HydrophobicContact CE-CG1 3.86Å; M128-L152 HydrophobicContact CB-CD1 3.74Å; M128-L152 HydrophobicContact CE-CD1 4.14Å; M128-L152 HydrophobicContact CE-CD2 3.94Å
129	I	98.1	Very high	97.5	Very high	31 Å²	31	51.2 Å²	51.2	16%	0.159	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-29.9	179.6	-76.6	164.2	0	0	0	111.9	L125 N126 L131 R151 L152	L125-I129 HydrophobicContact CD2-CD1 4.49Å; L125-I129 HydrophobicContact CG-CD1 4.07Å; L125-I129 WeakPolarHBondContact O-CD1 3.4Å; L125-I129 VanDerWaalsContact O-CG1 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.44Å; L125-I129 PolarHBondContact O-N 3.45Å; L125-I129 VanDerWaalsContact O-N 3.1Å; N126-I129 PolarHBondContact O-N 2.83Å; I129-L131 PolarHBondContact O-N 3.36Å; I129-R151 HydrophobicContact CD1-CB 4.42Å; I129-R151 HydrophobicContact CD1-CG 4.12Å; I129-R151 VanDerWaalsContact CD1-NE 3.26Å; I129-L152 HydrophobicContact CG1-CD1 3.97Å
130	D	97.6	Very high	97.6	Very high	60 Å²	60	49.4 Å²	49.4	32%	0.321	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	4.2	179.7	-68.4	-21.6	0	0	0	113.1	R11 R105 N126 E127 M128 E132	R11-D130 IonicContact CZ-OD2 3.42Å; R11-D130 IonicContact NH2-OD2 3.28Å; R11-D130 PolarHBondContact NH2-OD2 2.96Å; R105-D130 IonicContact NH1-OD2 2.7Å; N126-D130 PolarHBondContact O-N 3.22Å; E127-D130 PolarHBondContact O-N 2.84Å; M128-D130 PolarHBondContact O-N 2.93Å; D130-E132 VanDerWaalsContact C-N 3.34Å; D130-E132 PolarHBondContact O-N 2.89Å; D130-E132 VanDerWaalsContact O-N 3.15Å
131	L	98.2	Very high	97.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	23%	0.234	C	C	.	.			trans	-87.1	71.1	178.7	-56.7	175.4	0	0	0	111	L101 L107 L110 M128 I129 R133 L134 L156 Q158	L101-L131 HydrophobicContact CD2-CD1 4.14Å; L107-L131 HydrophobicContact CD1-CD1 4.22Å; L107-L131 HydrophobicContact CD1-CD2 4.38Å; L110-L131 HydrophobicContact CD2-CD1 3.83Å; M128-L131 VanDerWaalsContact O-CB 3.31Å; M128-L131 WeakPolarHBondContact O-CB 3.22Å; M128-L131 WeakPolarHBondContact O-CG 3.37Å; M128-L131 PolarHBondContact O-N 3.25Å; I129-L131 PolarHBondContact O-N 3.36Å; L131-R133 PolarHBondContact O-N 3.29Å; L131-L134 HydrophobicContact CB-CB 3.85Å; L131-L134 HydrophobicContact CD1-CD1 4.4Å; L131-L134 HydrophobicContact CD1-CD2 4.25Å; L131-L134 VanDerWaalsContact O-CB 3.23Å; L131-L134 WeakPolarHBondContact O-CB 3.47Å; L131-L134 PolarHBondContact O-N 2.95Å; L131-L156 WeakPolarHBondContact O-CD2 3.22Å; L131-Q158 PolarHBondContact O-NE2 3.25Å
132	E	96.8	Very high	97.5	Very high	154 Å²	154	48 Å²	48	72%	0.72	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-18.4	-175.8	-60.8	177.2	173.1	0	0	114.8	D130 Q158	D130-E132 VanDerWaalsContact C-N 3.34Å; D130-E132 PolarHBondContact O-N 2.89Å; D130-E132 VanDerWaalsContact O-N 3.15Å; E132-Q158 PolarHBondContact O-NE2 3.27Å
133	R	98	Very high	97.4	Very high	147 Å²	147	44.4 Å²	44.4	56%	0.555	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-0.8	-179.6	-65.5	179.6	174.4	-170.7	-5.3	113.4	N106 L107 L131 R135	N106-R133 PolarHBondContact OD1-NH1 2.76Å; L107-R133 CarbonylContact O-C 3.54Å; L131-R133 PolarHBondContact O-N 3.29Å; R133-R135 PolarHBondContact O-N 3.3Å
134	L	98.6	Very high	97.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	19%	0.187	C	C	.	.			trans	-70.8	122.3	-176.5	-165.5	74.3	0	0	0	110.4	L107 L110 L131 L137 L156 Q158 L159	L107-L134 HydrophobicContact CB-CD1 4.23Å; L107-L134 WeakPolarHBondContact O-CA 3.36Å; L107-L134 PolarHBondContact O-N 2.81Å; L110-L134 HydrophobicContact CB-CD1 3.54Å; L110-L134 HydrophobicContact CB-CD2 4.24Å; L110-L134 HydrophobicContact CD2-CD2 4.3Å; L131-L134 HydrophobicContact CB-CB 3.85Å; L131-L134 HydrophobicContact CD1-CD1 4.4Å; L131-L134 HydrophobicContact CD1-CD2 4.25Å; L131-L134 VanDerWaalsContact O-CB 3.23Å; L131-L134 WeakPolarHBondContact O-CB 3.47Å; L131-L134 PolarHBondContact O-N 2.95Å; L134-L137 HydrophobicContact CD2-CB 4.11Å; L134-L137 HydrophobicContact CD2-CD1 4.08Å; L134-L156 HydrophobicContact CB-CD2 4.34Å; L134-L156 HydrophobicContact CD2-CD1 4.02Å; L134-Q158 WeakPolarHBondContact O-CG 3.5Å; L134-Q158 PolarHBondContact O-NE2 3.43Å; L134-L159 HydrophobicContact CD2-CD2 4.3Å; L134-L159 HydrophobicContact CG-CD2 4.29Å
135	R	98.5	Very high	96.9	Very high	121 Å²	121	46.8 Å²	46.8	46%	0.457	21%	0.21	S	C	.	.			trans	-111.4	-31.5	179.8	-68.4	179.7	176	-146.1	3.4	112.4	R108 R133 E160 E161	R108-R135 PolarHBondContact O-N 3.07Å; R133-R135 PolarHBondContact O-N 3.3Å; R135-E160 HydrophobicContact CB-CB 4.49Å; R135-E160 HydrophobicContact CB-CG 4.36Å; R135-E160 VanDerWaalsContact CD-OE1 3.26Å; R135-E160 WeakPolarHBondContact CD-OE1 3.37Å; R135-E160 IonicContact CZ-OE1 2.64Å; R135-E160 VanDerWaalsContact CZ-OE1 3.28Å; R135-E160 IonicContact NE-OE1 3.79Å; R135-E160 PolarHBondContact NE-OE1 3.04Å; R135-E160 IonicContact NH1-OE1 3.23Å; R135-E160 PolarHBondContact NH1-OE1 3.49Å; R135-E160 PolarHBondContact O-N 3.41Å; R135-E161 PolarHBondContact O-N 2.85Å
136	K	98.7	Very high	96.5	Very high	48 Å²	48	47.5 Å²	47.5	21%	0.209	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126	176.8	175.3	175.6	-170.2	136.1	0	110.1	R108 E109 L110 E161 F163	R108-K136 PolarHBondContact O-N 2.9Å; E109-K136 WeakPolarHBondContact CA-O 3.39Å; E109-K136 HydrophobicContact CB-CB 4.09Å; E109-K136 HydrophobicContact CB-CD 4.24Å; E109-K136 HydrophobicContact CB-CG 4.46Å; E109-K136 HydrophobicContact CG-CB 3.91Å; E109-K136 HydrophobicContact CG-CD 4.13Å; L110-K136 PolarHBondContact N-O 3.19Å; K136-E161 WeakPolarHBondContact CA-O 3.29Å; K136-E161 HydrophobicContact CB-CB 4.12Å; K136-E161 VanDerWaalsContact CD-OE2 3.27Å; K136-E161 WeakPolarHBondContact CD-OE2 3.39Å; K136-E161 VanDerWaalsContact CE-OE2 3.28Å; K136-E161 WeakPolarHBondContact CE-OE2 3.26Å; K136-E161 HydrophobicContact CG-CB 4Å; K136-E161 IonicContact NZ-OE2 3.54Å; K136-E161 PolarHBondContact NZ-OE2 2.97Å; K136-F163 HydrophobicContact CD-CE2 4.35Å; K136-F163 HydrophobicContact CG-CE2 4.12Å
137	L	98.6	Very high	96.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	120.9	175.4	176.9	63.8	0	0	0	110	L110 M128 L134 V139 L152 L156 L159 E161 L162 F163	L110-L137 HydrophobicContact CB-CD1 4.32Å; L110-L137 HydrophobicContact CD2-CD1 3.97Å; L110-L137 HydrophobicContact CG-CD1 4.09Å; M128-L137 HydrophobicContact CE-CD1 3.49Å; M128-L137 VanDerWaalsContact CE-CD1 3.49Å; M128-L137 HydrophobicContact CE-CD2 4.16Å; M128-L137 HydrophobicContact CE-CG 4.45Å; L134-L137 HydrophobicContact CD2-CB 4.11Å; L134-L137 HydrophobicContact CD2-CD1 4.08Å; L137-V139 HydrophobicContact CD1-CG1 3.68Å; L137-V139 HydrophobicContact CD2-CG1 4.35Å; L137-V139 HydrophobicContact CG-CG1 3.99Å; L137-L152 HydrophobicContact CD2-CD2 3.96Å; L137-L152 HydrophobicContact CD2-CG 4.39Å; L137-L156 HydrophobicContact CD2-CD1 4.24Å; L137-L159 HydrophobicContact CB-CD1 4.32Å; L137-L159 HydrophobicContact CB-CD2 3.72Å; L137-L159 HydrophobicContact CD2-CD1 4.28Å; L137-E161 PolarHBondContact N-O 3.45Å; L137-L162 HydrophobicContact CB-CD1 4.3Å; L137-L162 HydrophobicContact CD2-CD1 4.14Å; L137-L162 HydrophobicContact CG-CD1 4.31Å; L137-L162 WeakPolarHBondContact O-CA 3.47Å; L137-F163 PolarHBondContact O-N 2.86Å
138	D	98.5	Very high	96.1	Very high	28 Å²	28	46.8 Å²	46.8	15%	0.15	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	115.6	169.9	-177.4	-1.8	0	0	0	109.8	L110 T111 I112 S140 F163	L110-D138 PolarHBondContact O-N 3.12Å; T111-D138 WeakPolarHBondContact CA-O 3.45Å; T111-D138 HydrophobicContact CG2-CB 4.06Å; I112-D138 PolarHBondContact N-O 2.68Å; D138-S140 WeakPolarHBondContact OD1-CB 3.19Å; D138-S140 PolarHBondContact OD1-N 3.49Å; D138-S140 PolarHBondContact OD1-OG 3.04Å; D138-F163 WeakPolarHBondContact CA-O 3.36Å; D138-F163 HydrophobicContact CB-CB 3.82Å; D138-F163 HydrophobicContact CB-CD2 4.12Å; D138-F163 HydrophobicContact CB-CG 4.19Å; D138-F163 WeakPolarHBondContact OD1-CB 3.37Å
139	V	97.8	Very high	95.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.221	C	C	.	.			trans	-125.6	27	177.3	-67.8	0	0	0	0	110.8	I112 I120 M128 L137 F141 C142 I144 F163 M164 T167	I112-V139 WeakPolarHBondContact O-CA 3.16Å; I120-V139 HydrophobicContact CD1-CB 3.84Å; I120-V139 HydrophobicContact CD1-CG1 3.47Å; I120-V139 VanDerWaalsContact CD1-CG1 3.47Å; M128-V139 HydrophobicContact CE-CG1 3.86Å; L137-V139 HydrophobicContact CD1-CG1 3.68Å; L137-V139 HydrophobicContact CD2-CG1 4.35Å; L137-V139 HydrophobicContact CG-CG1 3.99Å; V139-F141 PolarHBondContact O-N 2.88Å; V139-C142 HydrophobicContact CB-CB 4.33Å; V139-C142 VanDerWaalsContact O-CB 3.29Å; V139-C142 WeakPolarHBondContact O-CB 3.27Å; V139-C142 PolarHBondContact O-N 3.13Å; V139-I144 HydrophobicContact CB-CD1 4.37Å; V139-I144 HydrophobicContact CG2-CD1 4.15Å; V139-F163 PolarHBondContact N-O 2.93Å; V139-M164 HydrophobicContact CG2-CB 4.32Å; V139-T167 HydrophobicContact CG2-CG2 4.11Å; V139-T167 PolarHBondContact O-OG1 3.09Å
140	S	96.2	Very high	95.8	Very high	7 Å²	7	45.4 Å²	45.4	5%	0.049	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	130.7	-177	-56.3	0	0	0	0	110.1	H113 G114 D138 C142 D165	H113-S140 PolarHBondContact CD2-O 3.16Å; G114-S140 PolarHBondContact N-O 2.84Å; D138-S140 WeakPolarHBondContact OD1-CB 3.19Å; D138-S140 PolarHBondContact OD1-N 3.49Å; D138-S140 PolarHBondContact OD1-OG 3.04Å; S140-C142 PolarHBondContact O-N 3.46Å; S140-C142 VanDerWaalsContact O-N 3.15Å; S140-D165 CarbonylContact C-O 3.48Å; S140-D165 WeakPolarHBondContact CA-O 3.49Å
141	F	94.6	Very high	95.7	Very high	89 Å²	89	46.4 Å²	46.4	39%	0.39	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	8	-178.8	-49.1	-81.5	0	0	0	115.1	H113 G114 V139 D165	H113-F141 AromaticContact CD2-CD2 3.77Å; H113-F141 AromaticContact NE2-CD2 3.2Å; H113-F141 WeakPolarHBondContact NE2-CD2 3.37Å; H113-F141 AromaticContact NE2-CE2 3.8Å; G114-F141 WeakPolarHBondContact CA-O 3.43Å; V139-F141 PolarHBondContact O-N 2.88Å; F141-D165 HydrophobicContact CE2-CB 4.31Å; F141-D165 HydrophobicContact CZ-CB 4.16Å; F141-D165 PolarHBondContact N-O 2.82Å
142	C	94.6	Very high	95.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.213	C	C	.	.			trans	-82.1	126.1	165.9	-66.6	0	0	0	0	110.8	I112 L117 I120 V139 S140 I144 T167	I112-C142 PolarHBondContact O-SG 3.28Å; L117-C142 PolarHBondContact O-SG 2.76Å; I120-C142 HydrophobicContact CD1-CB 3.68Å; I120-C142 HydrophobicContact CG1-CB 3.94Å; V139-C142 HydrophobicContact CB-CB 4.33Å; V139-C142 VanDerWaalsContact O-CB 3.29Å; V139-C142 WeakPolarHBondContact O-CB 3.27Å; V139-C142 PolarHBondContact O-N 3.13Å; S140-C142 PolarHBondContact O-N 3.46Å; S140-C142 VanDerWaalsContact O-N 3.15Å; C142-I144 PolarHBondContact O-N 3.46Å; C142-T167 VanDerWaalsContact O-CA 3.22Å; C142-T167 WeakPolarHBondContact O-CA 3.48Å; C142-T167 VanDerWaalsContact O-CG2 3.29Å; C142-T167 WeakPolarHBondContact O-CG2 3.47Å
143	R	93.1	Very high	95.7	Very high	101 Å²	101	39 Å²	39	38%	0.381	18%	0.179	S	C	.	.	B	Isolated β-bridge	trans	-74.2	127	174.5	-63.1	176.4	-170.6	-172.1	0.4	112	S118 S119 I120 T167 L171	S118-R143 WeakPolarHBondContact O-CB 3.22Å; S118-R143 WeakPolarHBondContact O-CG 3.34Å; S118-R143 PolarHBondContact O-N 3.41Å; S119-R143 CarbonylContact C-O 3.38Å; S119-R143 WeakPolarHBondContact CA-O 3.49Å; S119-R143 WeakPolarHBondContact CB-O 3.48Å; S119-R143 PolarHBondContact OG-O 2.75Å; I120-R143 PolarHBondContact N-O 3.1Å; R143-T167 WeakPolarHBondContact CA-O 3.42Å; R143-L171 PolarHBondContact NH1-O 2.76Å; R143-L171 VanDerWaalsContact NH2-CB 3.29Å; R143-L171 PolarHBondContact NH2-O 2.75Å
144	I	94	Very high	95.7	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.056	18%	0.176	C	C	.	.			trans	-130	132.5	175.3	-43.1	-177.9	0	0	0	109.3	I120 V139 C142 A148 F149 L152 T167 L168	I120-I144 HydrophobicContact CB-CD1 4.26Å; I120-I144 HydrophobicContact CB-CG1 4.04Å; I120-I144 HydrophobicContact CD1-CD1 3.67Å; I120-I144 HydrophobicContact CD1-CG1 4.13Å; I120-I144 HydrophobicContact CG1-CD1 4.49Å; V139-I144 HydrophobicContact CB-CD1 4.37Å; V139-I144 HydrophobicContact CG2-CD1 4.15Å; C142-I144 PolarHBondContact O-N 3.46Å; I144-A148 HydrophobicContact CG2-CB 3.87Å; I144-F149 HydrophobicContact CB-CB 4.25Å; I144-F149 HydrophobicContact CB-CD2 4.5Å; I144-F149 HydrophobicContact CD1-CD2 3.89Å; I144-F149 HydrophobicContact CD1-CE2 4.46Å; I144-F149 HydrophobicContact CG2-CB 3.79Å; I144-F149 HydrophobicContact CG2-CD2 4.42Å; I144-L152 HydrophobicContact CD1-CD2 4.39Å; I144-T167 HydrophobicContact CB-CG2 4.3Å; I144-T167 HydrophobicContact CD1-CG2 3.7Å; I144-T167 HydrophobicContact CG1-CG2 3.75Å; I144-T167 PolarHBondContact N-O 3.5Å; I144-L168 WeakPolarHBondContact O-CD2 3.37Å
145	D	91	Very high	95.6	Very high	90 Å²	90	39.4 Å²	39.4	48%	0.481	19%	0.188	S	C	.	.			trans	-62.1	142.1	169.2	141.1	-113.4	0	0	0	110	S147 A148 F149	D145-S147 VanDerWaalsContact CG-N 3.33Å; D145-S147 PolarHBondContact O-N 2.86Å; D145-S147 WeakPolarHBondContact OD1-CB 3.29Å; D145-S147 PolarHBondContact OD1-N 3.39Å; D145-S147 PolarHBondContact OD1-OG 3.45Å; D145-S147 PolarHBondContact OD2-N 3.33Å; D145-A148 HydrophobicContact CB-CB 4.22Å; D145-A148 WeakPolarHBondContact O-CB 3.42Å; D145-A148 PolarHBondContact O-N 3.28Å; D145-A148 VanDerWaalsContact O-N 3.12Å; D145-A148 WeakPolarHBondContact OD1-CB 3.35Å; D145-A148 PolarHBondContact OD1-N 3.39Å; D145-F149 WeakPolarHBondContact O-CB 3.23Å; D145-F149 PolarHBondContact O-N 2.91Å
146	A	90	Very high	95.6	Very high	19 Å²	19	33.7 Å²	33.7	16%	0.157	17%	0.166	C	C	.	.	H	α-helix	trans	-55.1	-37.1	179.9	0	0	0	0	0	112.9	S150 A185 V189	A146-S150 WeakPolarHBondContact O-CB 3.37Å; A146-S150 PolarHBondContact O-N 3.3Å; A146-A185 HydrophobicContact CB-CB 3.6Å; A146-V189 HydrophobicContact CB-CG2 3.9Å
147	S	92.5	Very high	95.5	Very high	62 Å²	62	34 Å²	34	43%	0.434	17%	0.174	S	C	.	.	H	α-helix	trans	-69.8	-42.2	178.5	91.2	0	0	0	0	111.9	D145 R151	D145-S147 VanDerWaalsContact CG-N 3.33Å; D145-S147 PolarHBondContact O-N 2.86Å; D145-S147 WeakPolarHBondContact OD1-CB 3.29Å; D145-S147 PolarHBondContact OD1-N 3.39Å; D145-S147 PolarHBondContact OD1-OG 3.45Å; D145-S147 PolarHBondContact OD2-N 3.33Å; S147-R151 WeakPolarHBondContact O-CB 3.18Å; S147-R151 PolarHBondContact O-N 2.98Å
148	A	94.3	Very high	95.5	Very high	15 Å²	15	36.1 Å²	36.1	12%	0.124	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-45.4	173.4	0	0	0	0	0	111.4	L125 I144 D145 R151 L152	L125-A148 HydrophobicContact CD1-CB 4.3Å; L125-A148 HydrophobicContact CD2-CB 3.63Å; I144-A148 HydrophobicContact CG2-CB 3.87Å; D145-A148 HydrophobicContact CB-CB 4.22Å; D145-A148 WeakPolarHBondContact O-CB 3.42Å; D145-A148 PolarHBondContact O-N 3.28Å; D145-A148 VanDerWaalsContact O-N 3.12Å; D145-A148 WeakPolarHBondContact OD1-CB 3.35Å; D145-A148 PolarHBondContact OD1-N 3.39Å; A148-R151 WeakPolarHBondContact O-CB 2.91Å; A148-R151 PolarHBondContact O-N 2.95Å; A148-R151 VanDerWaalsContact O-N 3.17Å; A148-L152 PolarHBondContact O-N 2.96Å
149	F	95.5	Very high	95.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-44.8	178.4	-171.9	-114.1	0	0	0	111.9	I144 D145 R151 L152 L153 L162 M164 L168 V189 F193	I144-F149 HydrophobicContact CB-CB 4.25Å; I144-F149 HydrophobicContact CB-CD2 4.5Å; I144-F149 HydrophobicContact CD1-CD2 3.89Å; I144-F149 HydrophobicContact CD1-CE2 4.46Å; I144-F149 HydrophobicContact CG2-CB 3.79Å; I144-F149 HydrophobicContact CG2-CD2 4.42Å; D145-F149 WeakPolarHBondContact O-CB 3.23Å; D145-F149 PolarHBondContact O-N 2.91Å; F149-R151 PolarHBondContact O-N 3.36Å; F149-L152 HydrophobicContact CD2-CD2 4.38Å; F149-L152 VanDerWaalsContact O-CB 3.32Å; F149-L152 WeakPolarHBondContact O-CB 3.48Å; F149-L152 PolarHBondContact O-N 2.7Å; F149-L153 HydrophobicContact CD1-CD1 4.11Å; F149-L153 HydrophobicContact CE1-CD1 3.45Å; F149-L153 VanDerWaalsContact CE1-CD1 3.45Å; F149-L153 HydrophobicContact CE1-CG 4.08Å; F149-L153 HydrophobicContact CE2-CD1 4.42Å; F149-L153 HydrophobicContact CE2-CD2 4.2Å; F149-L153 HydrophobicContact CE2-CG 4.24Å; F149-L153 HydrophobicContact CZ-CD1 3.63Å; F149-L153 HydrophobicContact CZ-CD2 4.03Å; F149-L153 HydrophobicContact CZ-CG 3.93Å; F149-L153 PolarHBondContact O-N 2.84Å; F149-L162 HydrophobicContact CZ-CD2 4.47Å; F149-M164 HydrophobicContact CE1-CE 3.64Å; F149-M164 HydrophobicContact CE1-SD 4.1Å; F149-M164 HydrophobicContact CE2-CE 4.3Å; F149-M164 HydrophobicContact CZ-CE 3.46Å; F149-M164 VanDerWaalsContact CZ-CE 3.46Å; F149-M164 HydrophobicContact CZ-SD 3.56Å; F149-M164 VanDerWaalsContact CZ-SD 3.56Å; F149-L168 HydrophobicContact CB-CD2 4.33Å; F149-L168 HydrophobicContact CD1-CD1 4.07Å; F149-L168 HydrophobicContact CD1-CD2 4.23Å; F149-L168 HydrophobicContact CE1-CD1 4.12Å; F149-L168 HydrophobicContact CG-CD2 4.21Å; F149-V189 HydrophobicContact CD1-CG1 3.99Å; F149-V189 HydrophobicContact CD1-CG2 4.36Å; F149-V189 HydrophobicContact CE1-CG1 4.08Å; F149-F193 AromaticContact CE1-CE2 3.85Å; F149-F193 HydrophobicContact CE1-CE2 3.85Å
150	S	95.3	Very high	95.5	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-57.5	-38.8	172.4	175.2	0	0	0	0	112.1	A146 R154 L188	A146-S150 WeakPolarHBondContact O-CB 3.37Å; A146-S150 PolarHBondContact O-N 3.3Å; S150-R154 WeakPolarHBondContact O-CB 3.22Å; S150-R154 WeakPolarHBondContact O-CG 3.48Å; S150-R154 PolarHBondContact O-N 3.3Å; S150-R154 PolarHBondContact O-NE 3.47Å; S150-L188 VanDerWaalsContact CB-O 3.28Å; S150-L188 WeakPolarHBondContact CB-O 3.31Å; S150-L188 PolarHBondContact OG-O 2.86Å
151	R	96.4	Very high	95.6	Very high	80 Å²	80	39 Å²	39	30%	0.302	20%	0.195	S	C	.	.	H	α-helix	trans	-69.7	-35.4	175.6	-154.5	-175.2	81.1	-178	7.2	112.4	N126 I129 S147 A148 F149 G155	N126-R151 PolarHBondContact OD1-NH2 3.32Å; I129-R151 HydrophobicContact CD1-CB 4.42Å; I129-R151 HydrophobicContact CD1-CG 4.12Å; I129-R151 VanDerWaalsContact CD1-NE 3.26Å; S147-R151 WeakPolarHBondContact O-CB 3.18Å; S147-R151 PolarHBondContact O-N 2.98Å; A148-R151 WeakPolarHBondContact O-CB 2.91Å; A148-R151 PolarHBondContact O-N 2.95Å; A148-R151 VanDerWaalsContact O-N 3.17Å; F149-R151 PolarHBondContact O-N 3.36Å; R151-G155 PolarHBondContact O-N 3.12Å; R151-G155 VanDerWaalsContact O-N 3.15Å
152	L	97.5	Very high	95.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-55.7	176.5	-178.1	58.4	0	0	0	111.1	L125 M128 I129 L137 I144 A148 F149 R154 G155 L156	L125-L152 HydrophobicContact CD1-CB 3.84Å; L125-L152 HydrophobicContact CD1-CD1 4.28Å; L125-L152 HydrophobicContact CD1-CD2 4.23Å; L125-L152 HydrophobicContact CD1-CG 4.35Å; M128-L152 HydrophobicContact CB-CD1 3.74Å; M128-L152 HydrophobicContact CE-CD1 4.14Å; M128-L152 HydrophobicContact CE-CD2 3.94Å; I129-L152 HydrophobicContact CG1-CD1 3.97Å; L137-L152 HydrophobicContact CD2-CD2 3.96Å; L137-L152 HydrophobicContact CD2-CG 4.39Å; I144-L152 HydrophobicContact CD1-CD2 4.39Å; A148-L152 PolarHBondContact O-N 2.96Å; F149-L152 HydrophobicContact CD2-CD2 4.38Å; F149-L152 VanDerWaalsContact O-CB 3.32Å; F149-L152 WeakPolarHBondContact O-CB 3.48Å; F149-L152 PolarHBondContact O-N 2.7Å; L152-R154 VanDerWaalsContact C-N 3.32Å; L152-R154 PolarHBondContact O-N 3.28Å; L152-G155 WeakPolarHBondContact O-CA 3.33Å; L152-G155 PolarHBondContact O-N 3.21Å; L152-L156 HydrophobicContact CD1-CD1 3.58Å; L152-L156 HydrophobicContact CD1-CG 4.44Å; L152-L156 HydrophobicContact CG-CD1 4.12Å; L152-L156 PolarHBondContact O-N 3.44Å
153	L	97.5	Very high	96	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-36.3	-177.7	-62	-175.9	0	0	0	112.3	F149 G155 L156 L159 L162 A192 F193 L196	F149-L153 HydrophobicContact CD1-CD1 4.11Å; F149-L153 HydrophobicContact CE1-CD1 3.45Å; F149-L153 VanDerWaalsContact CE1-CD1 3.45Å; F149-L153 HydrophobicContact CE1-CG 4.08Å; F149-L153 HydrophobicContact CE2-CD1 4.42Å; F149-L153 HydrophobicContact CE2-CD2 4.2Å; F149-L153 HydrophobicContact CE2-CG 4.24Å; F149-L153 HydrophobicContact CZ-CD1 3.63Å; F149-L153 HydrophobicContact CZ-CD2 4.03Å; F149-L153 HydrophobicContact CZ-CG 3.93Å; F149-L153 PolarHBondContact O-N 2.84Å; L153-G155 PolarHBondContact O-N 2.77Å; L153-L156 CarbonylContact O-C 3.53Å; L153-L156 PolarHBondContact O-N 2.93Å; L153-L156 VanDerWaalsContact O-N 3.09Å; L153-L159 HydrophobicContact CD2-CD1 4.18Å; L153-L162 HydrophobicContact CD2-CD1 4.44Å; L153-L162 HydrophobicContact CD2-CD2 3.99Å; L153-A192 HydrophobicContact CB-CB 3.9Å; L153-A192 HydrophobicContact CD1-CB 4.15Å; L153-F193 HydrophobicContact CD1-CD2 3.82Å; L153-F193 HydrophobicContact CD1-CE2 3.93Å; L153-F193 HydrophobicContact CD1-CG 4.49Å; L153-L196 HydrophobicContact CB-CD2 4.33Å; L153-L196 HydrophobicContact CD1-CD1 4.11Å; L153-L196 HydrophobicContact CD2-CD1 4.19Å; L153-L196 HydrophobicContact CD2-CD2 4.42Å
154	R	96.4	Very high	96.1	Very high	130 Å²	130	31.3 Å²	31.3	49%	0.491	16%	0.164	S	C	.	.	H	α-helix	trans	-63.7	-28.3	171.8	-78.3	-172.5	-67.3	159.9	-5	113.7	S150 L152 L156 A192	S150-R154 WeakPolarHBondContact O-CB 3.22Å; S150-R154 WeakPolarHBondContact O-CG 3.48Å; S150-R154 PolarHBondContact O-N 3.3Å; S150-R154 PolarHBondContact O-NE 3.47Å; L152-R154 VanDerWaalsContact C-N 3.32Å; L152-R154 PolarHBondContact O-N 3.28Å; R154-L156 VanDerWaalsContact C-N 3.3Å; R154-A192 HydrophobicContact CG-CB 4.49Å
155	G	97.4	Very high	96.1	Very high	25 Å²	25	32 Å²	32	26%	0.258	17%	0.168	S	C	.	.	H	α-helix	trans	-78.9	-15.3	174.8	0	0	0	0	0	113.6	R151 L152 L153	R151-G155 PolarHBondContact O-N 3.12Å; R151-G155 VanDerWaalsContact O-N 3.15Å; L152-G155 WeakPolarHBondContact O-CA 3.33Å; L152-G155 PolarHBondContact O-N 3.21Å; L153-G155 PolarHBondContact O-N 2.77Å
156	L	98	Very high	96.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.			trans	-130.1	54.9	-171.9	-60.5	174.6	0	0	0	112.2	L131 L134 L137 L152 L153 R154 Q158 L159	L131-L156 WeakPolarHBondContact O-CD2 3.22Å; L134-L156 HydrophobicContact CB-CD2 4.34Å; L134-L156 HydrophobicContact CD2-CD1 4.02Å; L137-L156 HydrophobicContact CD2-CD1 4.24Å; L152-L156 HydrophobicContact CD1-CD1 3.58Å; L152-L156 HydrophobicContact CD1-CG 4.44Å; L152-L156 HydrophobicContact CG-CD1 4.12Å; L152-L156 PolarHBondContact O-N 3.44Å; L153-L156 CarbonylContact O-C 3.53Å; L153-L156 PolarHBondContact O-N 2.93Å; L153-L156 VanDerWaalsContact O-N 3.09Å; R154-L156 VanDerWaalsContact C-N 3.3Å; L156-Q158 PolarHBondContact O-N 3.2Å; L156-Q158 VanDerWaalsContact O-N 3.15Å; L156-L159 HydrophobicContact CB-CD1 3.73Å; L156-L159 HydrophobicContact CB-CG 3.88Å; L156-L159 HydrophobicContact CD1-CD1 4.18Å; L156-L159 WeakPolarHBondContact O-CG 3.31Å; L156-L159 PolarHBondContact O-N 2.92Å
157	P	97.4	Very high	96.3	Very high	55 Å²	55	26.9 Å²	26.9	36%	0.357	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.8	-179.1	28.8	-37.1	0	0	0	113.8	L159	P157-L159 VanDerWaalsContact C-N 3.31Å; P157-L159 PolarHBondContact O-N 3.49Å
158	Q	97.8	Very high	96	Very high	45 Å²	45	24.3 Å²	24.3	21%	0.21	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	4.9	-179.2	76.6	-71.5	-13.6	0	0	114.8	L131 E132 L134 L156 E160	L131-Q158 PolarHBondContact O-NE2 3.25Å; E132-Q158 PolarHBondContact O-NE2 3.27Å; L134-Q158 WeakPolarHBondContact O-CG 3.5Å; L134-Q158 PolarHBondContact O-NE2 3.43Å; L156-Q158 PolarHBondContact O-N 3.2Å; L156-Q158 VanDerWaalsContact O-N 3.15Å; Q158-E160 PolarHBondContact O-N 3.48Å
159	L	98.4	Very high	95.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.			trans	-61.8	131.5	178	-76	169.8	0	0	0	111.2	L134 L137 L153 L156 P157 L196 H198 L199	L134-L159 HydrophobicContact CD2-CD2 4.3Å; L134-L159 HydrophobicContact CG-CD2 4.29Å; L137-L159 HydrophobicContact CB-CD1 4.32Å; L137-L159 HydrophobicContact CB-CD2 3.72Å; L137-L159 HydrophobicContact CD2-CD1 4.28Å; L153-L159 HydrophobicContact CD2-CD1 4.18Å; L156-L159 HydrophobicContact CB-CD1 3.73Å; L156-L159 HydrophobicContact CB-CG 3.88Å; L156-L159 HydrophobicContact CD1-CD1 4.18Å; L156-L159 WeakPolarHBondContact O-CG 3.31Å; L156-L159 PolarHBondContact O-N 2.92Å; P157-L159 VanDerWaalsContact C-N 3.31Å; P157-L159 PolarHBondContact O-N 3.49Å; L159-L196 HydrophobicContact CB-CD2 4.37Å; L159-L196 HydrophobicContact CD1-CD2 4.44Å; L159-H198 CarbonylContact O-C 3.55Å; L159-L199 PolarHBondContact O-N 2.92Å
160	E	98.5	Very high	93.7	Very high	42 Å²	42	31.1 Å²	31.1	20%	0.196	15%	0.147	C	C	.	.	S	Bend	trans	-104.2	-32	175.1	-62.6	178.4	-155	0	0	111.1	R135 Q158 H198 R200 V201	R135-E160 HydrophobicContact CB-CB 4.49Å; R135-E160 HydrophobicContact CB-CG 4.36Å; R135-E160 VanDerWaalsContact CD-OE1 3.26Å; R135-E160 WeakPolarHBondContact CD-OE1 3.37Å; R135-E160 IonicContact CZ-OE1 2.64Å; R135-E160 VanDerWaalsContact CZ-OE1 3.28Å; R135-E160 IonicContact NE-OE1 3.79Å; R135-E160 PolarHBondContact NE-OE1 3.04Å; R135-E160 IonicContact NH1-OE1 3.23Å; R135-E160 PolarHBondContact NH1-OE1 3.49Å; R135-E160 PolarHBondContact O-N 3.41Å; Q158-E160 PolarHBondContact O-N 3.48Å; E160-H198 WeakPolarHBondContact CA-O 3.47Å; E160-R200 WeakPolarHBondContact O-CA 3.19Å; E160-R200 PolarHBondContact O-N 3.04Å; E160-V201 PolarHBondContact O-N 2.85Å
161	E	98.6	Very high	91.6	Very high	53 Å²	53	36.4 Å²	36.4	25%	0.248	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	128.6	178.2	-50.4	-178.2	-162.7	0	0	110.8	R135 K136 L137 F163 V201	R135-E161 PolarHBondContact O-N 2.85Å; K136-E161 WeakPolarHBondContact CA-O 3.29Å; K136-E161 HydrophobicContact CB-CB 4.12Å; K136-E161 VanDerWaalsContact CD-OE2 3.27Å; K136-E161 WeakPolarHBondContact CD-OE2 3.39Å; K136-E161 VanDerWaalsContact CE-OE2 3.28Å; K136-E161 WeakPolarHBondContact CE-OE2 3.26Å; K136-E161 HydrophobicContact CG-CB 4Å; K136-E161 IonicContact NZ-OE2 3.54Å; K136-E161 PolarHBondContact NZ-OE2 2.97Å; L137-E161 PolarHBondContact N-O 3.45Å; E161-F163 HydrophobicContact CB-CE2 3.76Å; E161-V201 WeakPolarHBondContact CA-O 3.17Å; E161-V201 HydrophobicContact CB-CB 4Å; E161-V201 HydrophobicContact CG-CB 3.88Å; E161-V201 HydrophobicContact CG-CG2 3.94Å
162	L	98.2	Very high	89.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.3	177.8	179.4	61.5	0	0	0	110.6	L137 F149 L153 M164 L196 L199 V201 L202 H203	L137-L162 HydrophobicContact CB-CD1 4.3Å; L137-L162 HydrophobicContact CD2-CD1 4.14Å; L137-L162 HydrophobicContact CG-CD1 4.31Å; L137-L162 WeakPolarHBondContact O-CA 3.47Å; F149-L162 HydrophobicContact CZ-CD2 4.47Å; L153-L162 HydrophobicContact CD2-CD1 4.44Å; L153-L162 HydrophobicContact CD2-CD2 3.99Å; L162-M164 HydrophobicContact CD2-SD 3.87Å; L162-M164 HydrophobicContact CG-CG 4.34Å; L162-M164 HydrophobicContact CG-SD 4.27Å; L162-L196 HydrophobicContact CD2-CD1 4.08Å; L162-L199 HydrophobicContact CB-CD1 3.76Å; L162-V201 PolarHBondContact N-O 2.82Å; L162-L202 HydrophobicContact CB-CD1 4.27Å; L162-L202 HydrophobicContact CD2-CD1 4.18Å; L162-L202 HydrophobicContact CG-CD1 4.29Å; L162-L202 WeakPolarHBondContact O-CA 2.99Å; L162-H203 PolarHBondContact O-N 2.94Å
163	F	98	Very high	87.3	Confident	28 Å²	28	50.4 Å²	50.4	12%	0.123	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.4	174.2	-51.8	-111.3	0	0	0	108.8	K136 L137 D138 V139 E161 V201 H203	K136-F163 HydrophobicContact CD-CE2 4.35Å; K136-F163 HydrophobicContact CG-CE2 4.12Å; L137-F163 PolarHBondContact O-N 2.86Å; D138-F163 WeakPolarHBondContact CA-O 3.36Å; D138-F163 HydrophobicContact CB-CB 3.82Å; D138-F163 HydrophobicContact CB-CD2 4.12Å; D138-F163 HydrophobicContact CB-CG 4.19Å; D138-F163 WeakPolarHBondContact OD1-CB 3.37Å; V139-F163 PolarHBondContact N-O 2.93Å; E161-F163 HydrophobicContact CB-CE2 3.76Å; F163-V201 HydrophobicContact CE1-CG1 4.49Å; F163-V201 HydrophobicContact CZ-CG1 4.05Å; F163-H203 HydrophobicContact CB-CB 4.24Å; F163-H203 HydrophobicContact CD1-CB 3.87Å; F163-H203 AromaticContact CD1-CD2 3.3Å; F163-H203 WeakPolarHBondContact CD1-CD2 3.49Å; F163-H203 AromaticContact CD1-CE1 3.96Å; F163-H203 AromaticContact CD1-CG 3.42Å; F163-H203 VanDerWaalsContact CD1-CG 3.42Å; F163-H203 AromaticContact CD1-ND1 3.82Å; F163-H203 AromaticContact CD1-NE2 3.66Å; F163-H203 AromaticContact CE1-CD2 3.24Å; F163-H203 WeakPolarHBondContact CE1-CD2 3.3Å; F163-H203 AromaticContact CE1-CE1 3.74Å; F163-H203 AromaticContact CE1-CG 3.82Å; F163-H203 AromaticContact CE1-NE2 3.17Å; F163-H203 WeakPolarHBondContact CE1-NE2 3.28Å; F163-H203 HydrophobicContact CG-CB 4.32Å
164	M	96.1	Very high	85.1	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.257	C	S	.	.			trans	-144.2	37.2	-172.7	61.3	175.1	-66.5	0	0	112.2	V139 F149 L162 G166 T167 L168 F193 H203 F204 N207	V139-M164 HydrophobicContact CG2-CB 4.32Å; F149-M164 HydrophobicContact CE1-CE 3.64Å; F149-M164 HydrophobicContact CE1-SD 4.1Å; F149-M164 HydrophobicContact CE2-CE 4.3Å; F149-M164 HydrophobicContact CZ-CE 3.46Å; F149-M164 VanDerWaalsContact CZ-CE 3.46Å; F149-M164 HydrophobicContact CZ-SD 3.56Å; F149-M164 VanDerWaalsContact CZ-SD 3.56Å; L162-M164 HydrophobicContact CD2-SD 3.87Å; L162-M164 HydrophobicContact CG-CG 4.34Å; L162-M164 HydrophobicContact CG-SD 4.27Å; M164-G166 PolarHBondContact O-N 3.47Å; M164-T167 WeakPolarHBondContact CA-OG1 3.24Å; M164-T167 HydrophobicContact CB-CG2 4.38Å; M164-T167 WeakPolarHBondContact O-CB 3.48Å; M164-T167 PolarHBondContact O-N 3Å; M164-T167 PolarHBondContact O-OG1 3.02Å; M164-L168 HydrophobicContact CE-CD1 3.45Å; M164-L168 VanDerWaalsContact CE-CD1 3.45Å; M164-L168 HydrophobicContact CE-CG 3.87Å; M164-F193 HydrophobicContact CE-CZ 4.45Å; M164-F193 HydrophobicContact SD-CE2 4.42Å; M164-F193 HydrophobicContact SD-CZ 3.74Å; M164-H203 VanDerWaalsContact CG-O 3.31Å; M164-H203 WeakPolarHBondContact CG-O 3.46Å; M164-H203 PolarHBondContact N-O 3.15Å; M164-H203 VanDerWaalsContact N-O 3.08Å; M164-F204 HydrophobicContact CE-CD2 3.85Å; M164-F204 HydrophobicContact CE-CE2 3.64Å; M164-F204 HydrophobicContact CG-CD2 3.98Å; M164-F204 HydrophobicContact SD-CD2 3.7Å; M164-F204 HydrophobicContact SD-CE2 4.05Å; M164-N207 PolarHBondContact O-ND2 3.07Å
165	D	94.4	Very high	83.1	Confident	25 Å²	25	56 Å²	56	13%	0.134	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	125.4	179.7	-64.7	-29.6	0	0	0	109.7	S140 F141 T167 F204 S205	S140-D165 CarbonylContact C-O 3.48Å; S140-D165 WeakPolarHBondContact CA-O 3.49Å; F141-D165 HydrophobicContact CE2-CB 4.31Å; F141-D165 HydrophobicContact CZ-CB 4.16Å; F141-D165 PolarHBondContact N-O 2.82Å; D165-T167 PolarHBondContact O-N 2.88Å; D165-F204 PolarHBondContact OD1-N 3.27Å; D165-S205 CarbonylContact C-O 3.5Å; D165-S205 VanDerWaalsContact CA-O 3.24Å; D165-S205 WeakPolarHBondContact CA-O 3.19Å; D165-S205 WeakPolarHBondContact OD1-CA 3.14Å; D165-S205 WeakPolarHBondContact OD1-CB 3.46Å; D165-S205 PolarHBondContact OD1-N 2.89Å; D165-S205 PolarHBondContact OD1-OG 2.86Å
166	G	92.8	Very high	81.1	Confident	2 Å²	2	63.1 Å²	63.1	2%	0.021	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	2.8	179.9	0	0	0	0	0	115.9	M164 L168 S169 S205 E206	M164-G166 PolarHBondContact O-N 3.47Å; G166-L168 VanDerWaalsContact C-N 3.34Å; G166-L168 PolarHBondContact O-N 3.08Å; G166-S169 WeakPolarHBondContact O-CB 3.47Å; G166-S169 PolarHBondContact O-N 3.42Å; G166-S169 PolarHBondContact O-OG 2.94Å; G166-S205 PolarHBondContact N-O 2.97Å; G166-E206 WeakPolarHBondContact CA-O 3.32Å
167	T	91.2	Very high	78.9	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.006	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-36.1	-174.8	-64.5	0	0	0	0	113.1	V139 C142 R143 I144 M164 D165 N207	V139-T167 HydrophobicContact CG2-CG2 4.11Å; V139-T167 PolarHBondContact O-OG1 3.09Å; C142-T167 VanDerWaalsContact O-CA 3.22Å; C142-T167 WeakPolarHBondContact O-CA 3.48Å; C142-T167 VanDerWaalsContact O-CG2 3.29Å; C142-T167 WeakPolarHBondContact O-CG2 3.47Å; R143-T167 WeakPolarHBondContact CA-O 3.42Å; I144-T167 HydrophobicContact CB-CG2 4.3Å; I144-T167 HydrophobicContact CD1-CG2 3.7Å; I144-T167 HydrophobicContact CG1-CG2 3.75Å; I144-T167 PolarHBondContact N-O 3.5Å; M164-T167 WeakPolarHBondContact CA-OG1 3.24Å; M164-T167 HydrophobicContact CB-CG2 4.38Å; M164-T167 WeakPolarHBondContact O-CB 3.48Å; M164-T167 PolarHBondContact O-N 3Å; M164-T167 PolarHBondContact O-OG1 3.02Å; D165-T167 PolarHBondContact O-N 2.88Å; T167-N207 PolarHBondContact N-OD1 2.72Å
168	L	87.1	Confident	77.1	Confident	7 Å²	7	75 Å²	75	4%	0.037	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	15.4	-179.5	-57.5	176.2	0	0	0	112.3	I144 F149 M164 G166 N207 K209 V210	I144-L168 WeakPolarHBondContact O-CD2 3.37Å; F149-L168 HydrophobicContact CB-CD2 4.33Å; F149-L168 HydrophobicContact CD1-CD1 4.07Å; F149-L168 HydrophobicContact CD1-CD2 4.23Å; F149-L168 HydrophobicContact CE1-CD1 4.12Å; F149-L168 HydrophobicContact CG-CD2 4.21Å; M164-L168 HydrophobicContact CE-CD1 3.45Å; M164-L168 VanDerWaalsContact CE-CD1 3.45Å; M164-L168 HydrophobicContact CE-CG 3.87Å; G166-L168 VanDerWaalsContact C-N 3.34Å; G166-L168 PolarHBondContact O-N 3.08Å; L168-N207 WeakPolarHBondContact CA-OD1 3.39Å; L168-N207 WeakPolarHBondContact CB-OD1 3.45Å; L168-N207 PolarHBondContact N-OD1 3.25Å; L168-K209 WeakPolarHBondContact O-CB 3.24Å; L168-K209 VanDerWaalsContact O-CD 3.27Å; L168-K209 WeakPolarHBondContact O-CD 3.42Å; L168-K209 VanDerWaalsContact O-CE 3.22Å; L168-K209 WeakPolarHBondContact O-CE 3.48Å; L168-K209 WeakPolarHBondContact O-CG 3.38Å; L168-K209 PolarHBondContact O-NZ 3.34Å; L168-V210 HydrophobicContact CB-CG2 4.01Å; L168-V210 HydrophobicContact CD1-CG2 3.45Å; L168-V210 VanDerWaalsContact CD1-CG2 3.45Å; L168-V210 HydrophobicContact CG-CG2 4.35Å
169	S	79.9	Confident	75.1	Confident	21 Å²	21	78.9 Å²	78.9	15%	0.147	38%	0.384	C	S	.	.			trans	-74.5	145.3	-177.1	69.5	0	0	0	0	114.9	G166 D208 K209	G166-S169 WeakPolarHBondContact O-CB 3.47Å; G166-S169 PolarHBondContact O-N 3.42Å; G166-S169 PolarHBondContact O-OG 2.94Å; S169-D208 WeakPolarHBondContact CA-OD1 3.48Å; S169-K209 PolarHBondContact O-NZ 3Å
170	Y	60.1	Low	73.1	Confident	137 Å²	137	86.8 Å²	86.8	54%	0.537	42%	0.421	S	S	.	.			trans	-95.9	69.8	170.5	-79.7	-61.9	0	0	0	110.1	R172 Y182 D208 K209	Y170-R172 PolarHBondContact O-N 2.94Å; Y170-Y182 HydrophobicContact CD2-CE1 4.22Å; Y170-Y182 HydrophobicContact CE2-CD1 4.35Å; Y170-Y182 AromaticContact CE2-CE1 3.7Å; Y170-Y182 HydrophobicContact CE2-CE1 3.7Å; Y170-D208 PolarHBondContact N-OD1 2.9Å; Y170-D208 VanDerWaalsContact N-OD1 3.07Å; Y170-D208 PolarHBondContact N-OD2 3.4Å; Y170-K209 VanDerWaalsContact CA-NZ 3.32Å; Y170-K209 HydrophobicContact CD1-CD 4.44Å; Y170-K209 VanDerWaalsContact CD1-CE 3.46Å; Y170-K209 HydrophobicContact CD2-CD 3.48Å; Y170-K209 VanDerWaalsContact CD2-CD 3.48Å; Y170-K209 HydrophobicContact CD2-CG 3.21Å; Y170-K209 HydrophobicContact CE1-CD 4.07Å; Y170-K209 HydrophobicContact CE2-CB 4.49Å; Y170-K209 HydrophobicContact CE2-CD 3.03Å; Y170-K209 HydrophobicContact CE2-CG 3.19Å; Y170-K209 HydrophobicContact CG-CD 4.16Å; Y170-K209 HydrophobicContact CG-CG 4.11Å; Y170-K209 WeakPolarHBondContact OH-CE 3.47Å
171	L	52.2	Low	71.1	Confident	113 Å²	113	94.3 Å²	94.3	59%	0.592	45%	0.453	S	S	*	.			trans	-76.7	70.6	164.1	-74.7	175.5	0	0	0	110.6	R143	R143-L171 PolarHBondContact NH1-O 2.76Å; R143-L171 VanDerWaalsContact NH2-CB 3.29Å; R143-L171 PolarHBondContact NH2-O 2.75Å
172	R	52.9	Low	69.1	Low	186 Å²	186	99.4 Å²	99.4	70%	0.702	47%	0.472	S	S	*	.			trans	-129.1	102.7	146.6	-95.9	-178	173.9	-165.2	5.9	107.3	Y170 D174	Y170-R172 PolarHBondContact O-N 2.94Å; R172-D174 HydrophobicContact CB-CB 4.38Å; R172-D174 VanDerWaalsContact CD-OD2 3.28Å; R172-D174 WeakPolarHBondContact CD-OD2 3.28Å; R172-D174 IonicContact NE-OD2 3.61Å; R172-D174 IonicContact NH1-OD2 2.8Å; R172-D174 PolarHBondContact O-N 3.02Å
173	K	50.2	Low	67	Low	188 Å²	188	106.9 Å²	106.9	82%	0.817	51%	0.506	S	S	*	.			trans	-62.7	33.7	158	-74.1	-178	171.9	178.7	0	111.7	N175	K173-N175 PolarHBondContact O-N 2.9Å
174	D	50.9	Low	65.3	Low	97 Å²	97	109.8 Å²	109.8	52%	0.519	53%	0.528	S	S	.	.			trans	-77.9	95.8	166.4	-68.6	-16.6	0	0	0	103.3	R172 Q176	R172-D174 HydrophobicContact CB-CB 4.38Å; R172-D174 VanDerWaalsContact CD-OD2 3.28Å; R172-D174 WeakPolarHBondContact CD-OD2 3.28Å; R172-D174 IonicContact NE-OD2 3.61Å; R172-D174 IonicContact NH1-OD2 2.8Å; R172-D174 PolarHBondContact O-N 3.02Å; D174-Q176 PolarHBondContact O-N 3.04Å
175	N	55.4	Low	64.4	Low	150 Å²	150	111 Å²	111	80%	0.802	54%	0.538	S	S	*	.			trans	-58.5	27	176.4	-68.8	-29.5	0	0	0	113.3	K173 R177	K173-N175 PolarHBondContact O-N 2.9Å; N175-R177 VanDerWaalsContact C-N 3.28Å; N175-R177 PolarHBondContact O-N 3.26Å
176	Q	55.6	Low	64	Low	176 Å²	176	110.4 Å²	110.4	82%	0.822	54%	0.535	S	S	*	.			trans	-81.3	83.8	-179.8	-66.5	-160	-4.7	0	0	109.1	D174 G178	D174-Q176 PolarHBondContact O-N 3.04Å; Q176-G178 PolarHBondContact O-N 3.42Å
177	R	51.3	Low	63.9	Low	253 Å²	253	114.1 Å²	114.1	96%	0.955	56%	0.561	S	S	*	*			trans	-13.6	97.5	149.8	-68.6	177.4	178.6	-173.5	-1.4	112.7	N175	N175-R177 VanDerWaalsContact C-N 3.28Å; N175-R177 PolarHBondContact O-N 3.26Å
178	G	60	Low	63.8	Low	52 Å²	52	117.5 Å²	117.5	54%	0.536	58%	0.578	S	S	.	*			trans	-170.1	98.4	166	0	0	0	0	0	106.9	Q176 Q180	Q176-G178 PolarHBondContact O-N 3.42Å; G178-Q180 PolarHBondContact O-N 2.88Å
179	S	55.6	Low	64.1	Low	126 Å²	126	117.2 Å²	117.2	88%	0.881	58%	0.577	S	S	*	*			trans	-62.3	66.4	168.4	-46.5	0	0	0	0	109.1	K181	S179-K181 PolarHBondContact O-N 3.12Å
180	Q	55.9	Low	64.8	Low	165 Å²	165	117.1 Å²	117.1	77%	0.771	58%	0.576	S	S	*	*			trans	-66.4	119.1	172.3	-81.8	-175.2	-14.8	0	0	106.3	G178 Y182	G178-Q180 PolarHBondContact O-N 2.88Å; Q180-Y182 WeakPolarHBondContact O-CD2 3.27Å; Q180-Y182 PolarHBondContact O-N 3.35Å
181	K	57	Low	66.4	Low	201 Å²	201	117.5 Å²	117.5	87%	0.874	58%	0.581	S	S	*	*			trans	-39.4	108.8	174.2	-69.9	178	174.5	-177.8	0	109.5	S179 E183	S179-K181 PolarHBondContact O-N 3.12Å; K181-E183 PolarHBondContact O-N 3.23Å
182	Y	57.2	Low	68.4	Low	160 Å²	160	112.1 Å²	112.1	63%	0.627	55%	0.553	S	S	*	*			trans	-71.2	9.2	-174.1	-84.2	-95.3	0	0	0	114.3	Y170 Q180	Y170-Y182 HydrophobicContact CD2-CE1 4.22Å; Y170-Y182 HydrophobicContact CE2-CD1 4.35Å; Y170-Y182 AromaticContact CE2-CE1 3.7Å; Y170-Y182 HydrophobicContact CE2-CE1 3.7Å; Q180-Y182 WeakPolarHBondContact O-CD2 3.27Å; Q180-Y182 PolarHBondContact O-N 3.35Å
183	E	52.7	Low	70.5	Confident	157 Å²	157	103.3 Å²	103.3	73%	0.734	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	77.6	-167.3	-112.9	-152.4	141.8	0	0	114.3	K181	K181-E183 PolarHBondContact O-N 3.23Å
184	P	62.3	Low	72.7	Confident	89 Å²	89	97 Å²	97	58%	0.578	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134	-7.8	131.7	4.4	17.1	0	0	0	114.4	S187	P184-S187 PolarHBondContact O-OG 2.68Å
185	A	77.9	Confident	74.8	Confident	26 Å²	26	95.3 Å²	95.3	22%	0.215	49%	0.49	C	S	.	.	H	α-helix	trans	-73.6	-41.5	-171.3	0	0	0	0	0	113	A146 S187 L188 V189	A146-A185 HydrophobicContact CB-CB 3.6Å; A185-S187 PolarHBondContact O-N 3.02Å; A185-L188 PolarHBondContact O-N 3.06Å; A185-V189 VanDerWaalsContact O-CG2 3.3Å; A185-V189 WeakPolarHBondContact O-CG2 3.41Å; A185-V189 PolarHBondContact O-N 3.17Å
186	N	86	Confident	76.8	Confident	12 Å²	12	88.2 Å²	88.2	6%	0.064	45%	0.452	C	S	.	.	H	α-helix	trans	-62.8	-42.5	-174.7	-67.2	-19.4	0	0	0	112.3	L188 V189 S190 T211 V214	N186-L188 PolarHBondContact O-N 3.47Å; N186-V189 PolarHBondContact O-N 3.48Å; N186-S190 WeakPolarHBondContact O-CB 3.45Å; N186-S190 PolarHBondContact O-N 2.95Å; N186-S190 PolarHBondContact O-OG 3.4Å; N186-T211 WeakPolarHBondContact ND2-CG2 3.5Å; N186-T211 PolarHBondContact ND2-OG1 2.76Å; N186-V214 HydrophobicContact CB-CG2 4.07Å
187	S	90	Very high	78.8	Confident	80 Å²	80	82.4 Å²	82.4	56%	0.559	43%	0.431	S	S	*	.	H	α-helix	trans	-64.7	-40.6	-179.3	63.2	0	0	0	0	112.3	P184 A185 K191	P184-S187 PolarHBondContact O-OG 2.68Å; A185-S187 PolarHBondContact O-N 3.02Å; S187-K191 WeakPolarHBondContact O-CB 3.45Å; S187-K191 PolarHBondContact O-N 2.8Å; S187-K191 VanDerWaalsContact O-N 3.09Å
188	L	89.9	Confident	81	Confident	71 Å²	71	75.2 Å²	75.2	37%	0.372	41%	0.408	S	S	.	.	H	α-helix	trans	-66	-43	177	-70.6	177.6	0	0	0	112.2	S150 A185 N186 A192	S150-L188 VanDerWaalsContact CB-O 3.28Å; S150-L188 WeakPolarHBondContact CB-O 3.31Å; S150-L188 PolarHBondContact OG-O 2.86Å; A185-L188 PolarHBondContact O-N 3.06Å; N186-L188 PolarHBondContact O-N 3.47Å; L188-A192 PolarHBondContact O-N 3.34Å
189	V	92.3	Very high	82.8	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.006	38%	0.382	C	S	.	.	H	α-helix	trans	-72.9	-42	-179.6	-177.9	0	0	0	0	110.1	A146 F149 A185 N186 K191 A192 F193 V214	A146-V189 HydrophobicContact CB-CG2 3.9Å; F149-V189 HydrophobicContact CD1-CG1 3.99Å; F149-V189 HydrophobicContact CD1-CG2 4.36Å; F149-V189 HydrophobicContact CE1-CG1 4.08Å; A185-V189 VanDerWaalsContact O-CG2 3.3Å; A185-V189 WeakPolarHBondContact O-CG2 3.41Å; A185-V189 PolarHBondContact O-N 3.17Å; N186-V189 PolarHBondContact O-N 3.48Å; V189-K191 PolarHBondContact O-N 3.05Å; V189-A192 WeakPolarHBondContact O-CA 3.45Å; V189-A192 VanDerWaalsContact O-CB 3.27Å; V189-A192 WeakPolarHBondContact O-CB 3.49Å; V189-A192 PolarHBondContact O-N 3.44Å; V189-F193 HydrophobicContact CG1-CD2 3.6Å; V189-F193 HydrophobicContact CG1-CE2 3.51Å; V189-F193 WeakPolarHBondContact O-CD2 3.15Å; V189-F193 PolarHBondContact O-N 2.9Å; V189-V214 HydrophobicContact CB-CG1 4.24Å; V189-V214 HydrophobicContact CB-CG2 4.11Å; V189-V214 HydrophobicContact CG1-CG1 3.53Å; V189-V214 HydrophobicContact CG1-CG2 4.23Å
190	S	94.5	Very high	84.9	Confident	20 Å²	20	71.3 Å²	71.3	14%	0.14	36%	0.358	C	S	.	.	H	α-helix	trans	-55.5	-51.4	175.8	-59.7	0	0	0	0	111.7	N186 A192 F193 S194 V214 S217	N186-S190 WeakPolarHBondContact O-CB 3.45Å; N186-S190 PolarHBondContact O-N 2.95Å; N186-S190 PolarHBondContact O-OG 3.4Å; S190-A192 PolarHBondContact O-N 3.25Å; S190-A192 VanDerWaalsContact O-N 3.08Å; S190-F193 PolarHBondContact O-N 3Å; S190-F193 VanDerWaalsContact O-N 3.17Å; S190-S194 PolarHBondContact O-N 3.28Å; S190-V214 WeakPolarHBondContact OG-CA 3.35Å; S190-V214 WeakPolarHBondContact OG-CG2 3.34Å; S190-S217 VanDerWaalsContact C-OG 3.29Å; S190-S217 WeakPolarHBondContact CA-OG 3.21Å; S190-S217 WeakPolarHBondContact CB-OG 3.46Å; S190-S217 WeakPolarHBondContact O-CB 3.39Å; S190-S217 PolarHBondContact O-OG 3.23Å
191	K	94.1	Very high	86.9	Confident	145 Å²	145	64 Å²	64	63%	0.63	32%	0.324	S	S	*	.	H	α-helix	trans	-60.2	-24.5	176.4	-175.8	172	-177.3	173.8	0	113	S187 V189 S194 N195	S187-K191 WeakPolarHBondContact O-CB 3.45Å; S187-K191 PolarHBondContact O-N 2.8Å; S187-K191 VanDerWaalsContact O-N 3.09Å; V189-K191 PolarHBondContact O-N 3.05Å; K191-S194 PolarHBondContact O-OG 3.3Å; K191-N195 PolarHBondContact O-ND2 2.89Å
192	A	95.1	Very high	88.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-80.2	-44.9	177.6	0	0	0	0	0	111.3	L153 R154 L188 V189 S190 S194 N195	L153-A192 HydrophobicContact CB-CB 3.9Å; L153-A192 HydrophobicContact CD1-CB 4.15Å; R154-A192 HydrophobicContact CG-CB 4.49Å; L188-A192 PolarHBondContact O-N 3.34Å; V189-A192 WeakPolarHBondContact O-CA 3.45Å; V189-A192 VanDerWaalsContact O-CB 3.27Å; V189-A192 WeakPolarHBondContact O-CB 3.49Å; V189-A192 PolarHBondContact O-N 3.44Å; S190-A192 PolarHBondContact O-N 3.25Å; S190-A192 VanDerWaalsContact O-N 3.08Å; A192-S194 VanDerWaalsContact C-N 3.27Å; A192-S194 PolarHBondContact O-N 3.3Å; A192-N195 PolarHBondContact O-N 2.83Å; A192-N195 VanDerWaalsContact O-N 3.13Å; A192-N195 PolarHBondContact O-ND2 3.08Å
193	F	96.4	Very high	90.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.4	-36.8	174	-92.2	-101.6	0	0	0	112.5	F149 L153 M164 V189 S190 N195 L196 L202 F204 V214 L215 L218 P219	F149-F193 AromaticContact CE1-CE2 3.85Å; F149-F193 HydrophobicContact CE1-CE2 3.85Å; L153-F193 HydrophobicContact CD1-CD2 3.82Å; L153-F193 HydrophobicContact CD1-CE2 3.93Å; L153-F193 HydrophobicContact CD1-CG 4.49Å; M164-F193 HydrophobicContact CE-CZ 4.45Å; M164-F193 HydrophobicContact SD-CE2 4.42Å; M164-F193 HydrophobicContact SD-CZ 3.74Å; V189-F193 HydrophobicContact CG1-CD2 3.6Å; V189-F193 HydrophobicContact CG1-CE2 3.51Å; V189-F193 WeakPolarHBondContact O-CD2 3.15Å; V189-F193 PolarHBondContact O-N 2.9Å; S190-F193 PolarHBondContact O-N 3Å; S190-F193 VanDerWaalsContact O-N 3.17Å; F193-N195 PolarHBondContact O-N 2.88Å; F193-L196 HydrophobicContact CD1-CD1 4.45Å; F193-L196 WeakPolarHBondContact O-CB 3.47Å; F193-L196 PolarHBondContact O-N 3.44Å; F193-L202 HydrophobicContact CE1-CD1 4.37Å; F193-L202 HydrophobicContact CE1-CD2 4.26Å; F193-F204 HydrophobicContact CZ-CD2 4.5Å; F193-F204 HydrophobicContact CZ-CE2 4.44Å; F193-V214 HydrophobicContact CD2-CG1 3.55Å; F193-V214 HydrophobicContact CE2-CG1 3.61Å; F193-V214 HydrophobicContact CG-CG1 4.07Å; F193-V214 HydrophobicContact CZ-CG1 4.24Å; F193-L215 HydrophobicContact CE1-CD2 4.03Å; F193-L215 HydrophobicContact CZ-CD2 4.46Å; F193-L218 HydrophobicContact CB-CB 4.49Å; F193-L218 HydrophobicContact CD1-CB 4.02Å; F193-L218 HydrophobicContact CD1-CD1 3.75Å; F193-L218 HydrophobicContact CD1-CD2 4.47Å; F193-L218 HydrophobicContact CD1-CG 4.27Å; F193-P219 VanDerWaalsContact O-CD 3.3Å; F193-P219 WeakPolarHBondContact O-CD 3.34Å
194	S	96.4	Very high	92.7	Very high	55 Å²	55	41 Å²	41	39%	0.385	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.1	177.4	71.8	0	0	0	0	114.4	S190 K191 A192 S217	S190-S194 PolarHBondContact O-N 3.28Å; K191-S194 PolarHBondContact O-OG 3.3Å; A192-S194 VanDerWaalsContact C-N 3.27Å; A192-S194 PolarHBondContact O-N 3.3Å; S194-S217 VanDerWaalsContact CA-O 3.29Å; S194-S217 WeakPolarHBondContact CA-O 3.04Å; S194-S217 WeakPolarHBondContact CB-O 3.41Å
195	N	96.2	Very high	94.1	Very high	63 Å²	63	37 Å²	37	34%	0.337	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-6.3	176.6	-50.3	-62.1	0	0	0	113.5	K191 A192 F193 S197	K191-N195 PolarHBondContact O-ND2 2.89Å; A192-N195 PolarHBondContact O-N 2.83Å; A192-N195 VanDerWaalsContact O-N 3.13Å; A192-N195 PolarHBondContact O-ND2 3.08Å; F193-N195 PolarHBondContact O-N 2.88Å; N195-S197 PolarHBondContact O-N 3.48Å
196	L	97.5	Very high	94.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.			trans	-85.6	59.1	-178	-57.3	-178	0	0	0	111	L153 L159 L162 F193 H198 L199 L218	L153-L196 HydrophobicContact CB-CD2 4.33Å; L153-L196 HydrophobicContact CD1-CD1 4.11Å; L153-L196 HydrophobicContact CD2-CD1 4.19Å; L153-L196 HydrophobicContact CD2-CD2 4.42Å; L159-L196 HydrophobicContact CB-CD2 4.37Å; L159-L196 HydrophobicContact CD1-CD2 4.44Å; L162-L196 HydrophobicContact CD2-CD1 4.08Å; F193-L196 HydrophobicContact CD1-CD1 4.45Å; F193-L196 WeakPolarHBondContact O-CB 3.47Å; F193-L196 PolarHBondContact O-N 3.44Å; L196-H198 PolarHBondContact O-N 3.32Å; L196-L199 HydrophobicContact CB-CB 4.11Å; L196-L199 HydrophobicContact CD1-CD2 4.21Å; L196-L199 WeakPolarHBondContact O-CB 3.18Å; L196-L199 PolarHBondContact O-N 3.34Å; L196-L218 HydrophobicContact CB-CD1 4.19Å
197	S	96.7	Very high	94.8	Very high	54 Å²	54	38.9 Å²	38.9	38%	0.378	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-15	-175.6	55.1	0	0	0	0	114.3	N195 H222	N195-S197 PolarHBondContact O-N 3.48Å; S197-H222 PolarHBondContact O-CD2 2.87Å
198	H	97.8	Very high	94.4	Very high	102 Å²	102	38.3 Å²	38.3	47%	0.472	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	4.4	-179.2	-60.8	-61.1	0	0	0	113.3	L159 E160 L196 R200	L159-H198 CarbonylContact O-C 3.55Å; E160-H198 WeakPolarHBondContact CA-O 3.47Å; L196-H198 PolarHBondContact O-N 3.32Å; H198-R200 PolarHBondContact O-N 2.94Å
199	L	98.4	Very high	93.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.			trans	-67.9	122.5	-174.2	-161	72.4	0	0	0	111	L159 L162 L196 L202 L218 H222 L223	L159-L199 PolarHBondContact O-N 2.92Å; L162-L199 HydrophobicContact CB-CD1 3.76Å; L196-L199 HydrophobicContact CB-CB 4.11Å; L196-L199 HydrophobicContact CD1-CD2 4.21Å; L196-L199 WeakPolarHBondContact O-CB 3.18Å; L196-L199 PolarHBondContact O-N 3.34Å; L199-L202 HydrophobicContact CD2-CB 4.11Å; L199-L202 HydrophobicContact CD2-CD1 4.31Å; L199-L218 HydrophobicContact CB-CD1 4.42Å; L199-L218 HydrophobicContact CD2-CD1 3.57Å; L199-L218 HydrophobicContact CD2-CD2 4.17Å; L199-L218 HydrophobicContact CD2-CG 4.5Å; L199-H222 CarbonylContact O-C 3.35Å; L199-L223 HydrophobicContact CD2-CD1 4.5Å; L199-L223 HydrophobicContact CG-CD1 4.49Å
200	R	98.4	Very high	93	Very high	97 Å²	97	37.4 Å²	37.4	37%	0.366	19%	0.188	S	C	.	.			trans	-111	-31.3	179.3	-66.5	172.1	67.8	-141.3	-6.6	112.2	E160 H198 H222 E224 E225	E160-R200 WeakPolarHBondContact O-CA 3.19Å; E160-R200 PolarHBondContact O-N 3.04Å; H198-R200 PolarHBondContact O-N 2.94Å; R200-H222 WeakPolarHBondContact CA-O 3.38Å; R200-E224 IonicContact CZ-OE1 2.91Å; R200-E224 IonicContact CZ-OE2 3.39Å; R200-E224 IonicContact NE-OE1 3.61Å; R200-E224 PolarHBondContact NE-OE1 2.68Å; R200-E224 IonicContact NH2-OE1 2.62Å; R200-E224 PolarHBondContact NH2-OE1 3.47Å; R200-E224 IonicContact NH2-OE2 3.26Å; R200-E224 PolarHBondContact NH2-OE2 3.08Å; R200-E224 WeakPolarHBondContact O-CA 3.32Å; R200-E224 PolarHBondContact O-N 2.74Å; R200-E225 PolarHBondContact O-N 2.9Å
201	V	98.5	Very high	92.3	Very high	12 Å²	12	38.7 Å²	38.7	7%	0.073	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.7	180	178.8	0	0	0	0	109.7	E160 E161 L162 F163 E225	E160-V201 PolarHBondContact O-N 2.85Å; E161-V201 WeakPolarHBondContact CA-O 3.17Å; E161-V201 HydrophobicContact CB-CB 4Å; E161-V201 HydrophobicContact CG-CB 3.88Å; E161-V201 HydrophobicContact CG-CG2 3.94Å; L162-V201 PolarHBondContact N-O 2.82Å; F163-V201 HydrophobicContact CE1-CG1 4.49Å; F163-V201 HydrophobicContact CZ-CG1 4.05Å; V201-E225 WeakPolarHBondContact CA-O 3.17Å; V201-E225 HydrophobicContact CB-CB 4.4Å; V201-E225 HydrophobicContact CG1-CB 4.13Å; V201-E225 HydrophobicContact CG2-CB 4.07Å; V201-E225 HydrophobicContact CG2-CG 4.02Å
202	L	97.8	Very high	91.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119	173.6	178.7	62	0	0	0	111.1	L162 F193 L199 F204 L215 L218 L223 E225 L226 Y227	L162-L202 HydrophobicContact CB-CD1 4.27Å; L162-L202 HydrophobicContact CD2-CD1 4.18Å; L162-L202 HydrophobicContact CG-CD1 4.29Å; L162-L202 WeakPolarHBondContact O-CA 2.99Å; F193-L202 HydrophobicContact CE1-CD1 4.37Å; F193-L202 HydrophobicContact CE1-CD2 4.26Å; L199-L202 HydrophobicContact CD2-CB 4.11Å; L199-L202 HydrophobicContact CD2-CD1 4.31Å; L202-F204 HydrophobicContact CD1-CB 4.3Å; L202-F204 HydrophobicContact CD2-CB 4.35Å; L202-F204 HydrophobicContact CG-CB 4.1Å; L202-L215 HydrophobicContact CD2-CD2 3.89Å; L202-L218 HydrophobicContact CD2-CD2 3.68Å; L202-L223 HydrophobicContact CB-CD1 3.99Å; L202-E225 PolarHBondContact N-O 2.69Å; L202-L226 HydrophobicContact CB-CD1 4.31Å; L202-L226 HydrophobicContact CD2-CD1 4.15Å; L202-L226 HydrophobicContact CG-CD1 4.38Å; L202-Y227 PolarHBondContact O-N 3Å
203	H	97.2	Very high	91	Very high	30 Å²	30	37.1 Å²	37.1	14%	0.139	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114	163.5	-70.3	-125.2	0	0	0	109.6	L162 F163 M164 Y227	L162-H203 PolarHBondContact O-N 2.94Å; F163-H203 HydrophobicContact CB-CB 4.24Å; F163-H203 HydrophobicContact CD1-CB 3.87Å; F163-H203 AromaticContact CD1-CD2 3.3Å; F163-H203 WeakPolarHBondContact CD1-CD2 3.49Å; F163-H203 AromaticContact CD1-CE1 3.96Å; F163-H203 AromaticContact CD1-CG 3.42Å; F163-H203 VanDerWaalsContact CD1-CG 3.42Å; F163-H203 AromaticContact CD1-ND1 3.82Å; F163-H203 AromaticContact CD1-NE2 3.66Å; F163-H203 AromaticContact CE1-CD2 3.24Å; F163-H203 WeakPolarHBondContact CE1-CD2 3.3Å; F163-H203 AromaticContact CE1-CE1 3.74Å; F163-H203 AromaticContact CE1-CG 3.82Å; F163-H203 AromaticContact CE1-NE2 3.17Å; F163-H203 WeakPolarHBondContact CE1-NE2 3.28Å; F163-H203 HydrophobicContact CG-CB 4.32Å; M164-H203 VanDerWaalsContact CG-O 3.31Å; M164-H203 WeakPolarHBondContact CG-O 3.46Å; M164-H203 PolarHBondContact N-O 3.15Å; M164-H203 VanDerWaalsContact N-O 3.08Å; H203-Y227 AromaticContact CD2-CD2 3.32Å; H203-Y227 WeakPolarHBondContact CD2-CD2 3.3Å; H203-Y227 AromaticContact CD2-CE2 3.68Å; H203-Y227 AromaticContact CD2-CG 3.96Å; H203-Y227 AromaticContact CE1-CD1 3.61Å; H203-Y227 AromaticContact CE1-CD2 3.38Å; H203-Y227 WeakPolarHBondContact CE1-CD2 3.47Å; H203-Y227 AromaticContact CE1-CE1 3.75Å; H203-Y227 AromaticContact CE1-CE2 3.5Å; H203-Y227 AromaticContact CE1-CG 3.46Å; H203-Y227 VanDerWaalsContact CE1-CG 3.46Å; H203-Y227 AromaticContact CE1-CZ 3.69Å; H203-Y227 AromaticContact CG-CD2 3.73Å; H203-Y227 AromaticContact CG-CG 3.9Å; H203-Y227 AromaticContact ND1-CD2 3.77Å; H203-Y227 AromaticContact ND1-CG 3.61Å; H203-Y227 AromaticContact NE2-CD2 3.1Å; H203-Y227 WeakPolarHBondContact NE2-CD2 3.5Å; H203-Y227 AromaticContact NE2-CE2 3.02Å; H203-Y227 WeakPolarHBondContact NE2-CE2 3.44Å; H203-Y227 AromaticContact NE2-CG 3.71Å; H203-Y227 AromaticContact NE2-CZ 3.58Å
204	F	94.3	Very high	90.7	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.013	19%	0.191	C	C	.	.			trans	-133.5	71.4	-177.3	-169.8	-92.8	0	0	0	110	M164 D165 F193 L202 N207 V210 L215 Y227 L228	M164-F204 HydrophobicContact CE-CD2 3.85Å; M164-F204 HydrophobicContact CE-CE2 3.64Å; M164-F204 HydrophobicContact CG-CD2 3.98Å; M164-F204 HydrophobicContact SD-CD2 3.7Å; M164-F204 HydrophobicContact SD-CE2 4.05Å; D165-F204 PolarHBondContact OD1-N 3.27Å; F193-F204 HydrophobicContact CZ-CD2 4.5Å; F193-F204 HydrophobicContact CZ-CE2 4.44Å; L202-F204 HydrophobicContact CD1-CB 4.3Å; L202-F204 HydrophobicContact CD2-CB 4.35Å; L202-F204 HydrophobicContact CG-CB 4.1Å; F204-N207 HydrophobicContact CD1-CB 4.44Å; F204-N207 HydrophobicContact CE1-CB 3.82Å; F204-N207 HydrophobicContact CE2-CB 4.03Å; F204-N207 HydrophobicContact CZ-CB 3.6Å; F204-V210 HydrophobicContact CZ-CB 3.86Å; F204-V210 HydrophobicContact CZ-CG1 3.77Å; F204-L215 HydrophobicContact CD1-CD1 3.84Å; F204-L215 HydrophobicContact CD1-CD2 4.26Å; F204-L215 HydrophobicContact CD1-CG 4.4Å; F204-L215 HydrophobicContact CD2-CD2 4.25Å; F204-L215 HydrophobicContact CE1-CD1 4.07Å; F204-L215 HydrophobicContact CE1-CD2 4.47Å; F204-L215 HydrophobicContact CE1-CG 4.37Å; F204-L215 HydrophobicContact CE2-CD2 4.45Å; F204-L215 HydrophobicContact CG-CD1 4.44Å; F204-L215 HydrophobicContact CG-CD2 4.14Å; F204-Y227 CarbonylContact C-O 3.37Å; F204-Y227 PolarHBondContact N-O 3.08Å; F204-L228 HydrophobicContact CB-CD2 3.95Å; F204-L228 HydrophobicContact CD1-CD2 4.1Å; F204-L228 HydrophobicContact CG-CD2 4.48Å
205	S	91.5	Very high	90.6	Very high	6 Å²	6	34.6 Å²	34.6	4%	0.042	17%	0.173	C	C	.	.			trans	-108.1	155.7	179.5	-45.7	0	0	0	0	111.5	D165 G166 N207 N229	D165-S205 CarbonylContact C-O 3.5Å; D165-S205 VanDerWaalsContact CA-O 3.24Å; D165-S205 WeakPolarHBondContact CA-O 3.19Å; D165-S205 WeakPolarHBondContact OD1-CA 3.14Å; D165-S205 WeakPolarHBondContact OD1-CB 3.46Å; D165-S205 PolarHBondContact OD1-N 2.89Å; D165-S205 PolarHBondContact OD1-OG 2.86Å; G166-S205 PolarHBondContact N-O 2.97Å; S205-N207 PolarHBondContact O-N 3.43Å; S205-N207 PolarHBondContact O-ND2 3.24Å; S205-N229 CarbonylContact C-O 3.18Å; S205-N229 WeakPolarHBondContact CA-O 3.14Å; S205-N229 VanDerWaalsContact CB-O 3.31Å; S205-N229 WeakPolarHBondContact CB-O 3.31Å; S205-N229 WeakPolarHBondContact OG-CB 3.35Å; S205-N229 PolarHBondContact OG-N 3.17Å
206	E	89.5	Confident	90.5	Very high	73 Å²	73	34.6 Å²	34.6	34%	0.341	17%	0.172	S	C	.	.	S	Bend	trans	56.6	24.8	170.8	-53.7	-166.1	-178.8	0	0	115.5	G166 N229 K230	G166-E206 WeakPolarHBondContact CA-O 3.32Å; E206-N229 PolarHBondContact N-O 3.43Å; E206-K230 HydrophobicContact CG-CB 4.27Å; E206-K230 HydrophobicContact CG-CD 3.89Å; E206-K230 WeakPolarHBondContact OE1-CD 3.37Å; E206-K230 IonicContact OE1-NZ 3.96Å; E206-K230 PolarHBondContact OE1-NZ 2.88Å
207	N	87.8	Confident	90.4	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	18%	0.184	C	C	.	.			trans	-96.9	90	178	-75.1	-67.9	0	0	0	110.9	M164 T167 L168 F204 S205	M164-N207 PolarHBondContact O-ND2 3.07Å; T167-N207 PolarHBondContact N-OD1 2.72Å; L168-N207 WeakPolarHBondContact CA-OD1 3.39Å; L168-N207 WeakPolarHBondContact CB-OD1 3.45Å; L168-N207 PolarHBondContact N-OD1 3.25Å; F204-N207 HydrophobicContact CD1-CB 4.44Å; F204-N207 HydrophobicContact CE1-CB 3.82Å; F204-N207 HydrophobicContact CE2-CB 4.03Å; F204-N207 HydrophobicContact CZ-CB 3.6Å; S205-N207 PolarHBondContact O-N 3.43Å; S205-N207 PolarHBondContact O-ND2 3.24Å
208	D	82.1	Confident	90.3	Very high	69 Å²	69	34 Å²	34	37%	0.369	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-15.2	-173.2	64.3	1.9	0	0	0	115.7	S169 Y170	S169-D208 WeakPolarHBondContact CA-OD1 3.48Å; Y170-D208 PolarHBondContact N-OD1 2.9Å; Y170-D208 VanDerWaalsContact N-OD1 3.07Å; Y170-D208 PolarHBondContact N-OD2 3.4Å
209	K	74.5	Confident	90.2	Very high	46 Å²	46	31 Å²	31	20%	0.2	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-23.7	-177.8	-76.1	-164.9	-145.4	7	0	115.9	L168 S169 Y170	L168-K209 WeakPolarHBondContact O-CB 3.24Å; L168-K209 VanDerWaalsContact O-CD 3.27Å; L168-K209 WeakPolarHBondContact O-CD 3.42Å; L168-K209 VanDerWaalsContact O-CE 3.22Å; L168-K209 WeakPolarHBondContact O-CE 3.48Å; L168-K209 WeakPolarHBondContact O-CG 3.38Å; L168-K209 PolarHBondContact O-NZ 3.34Å; S169-K209 PolarHBondContact O-NZ 3Å; Y170-K209 VanDerWaalsContact CA-NZ 3.32Å; Y170-K209 HydrophobicContact CD1-CD 4.44Å; Y170-K209 VanDerWaalsContact CD1-CE 3.46Å; Y170-K209 HydrophobicContact CD2-CD 3.48Å; Y170-K209 VanDerWaalsContact CD2-CD 3.48Å; Y170-K209 HydrophobicContact CD2-CG 3.21Å; Y170-K209 HydrophobicContact CE1-CD 4.07Å; Y170-K209 HydrophobicContact CE2-CB 4.49Å; Y170-K209 HydrophobicContact CE2-CD 3.03Å; Y170-K209 HydrophobicContact CE2-CG 3.19Å; Y170-K209 HydrophobicContact CG-CD 4.16Å; Y170-K209 HydrophobicContact CG-CG 4.11Å; Y170-K209 WeakPolarHBondContact OH-CE 3.47Å
210	V	77.5	Confident	90.1	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.036	16%	0.158	C	C	.	.			trans	-100.7	117	-164.5	172.6	0	0	0	0	107.2	L168 F204 V214 A233	L168-V210 HydrophobicContact CB-CG2 4.01Å; L168-V210 HydrophobicContact CD1-CG2 3.45Å; L168-V210 VanDerWaalsContact CD1-CG2 3.45Å; L168-V210 HydrophobicContact CG-CG2 4.35Å; F204-V210 HydrophobicContact CZ-CB 3.86Å; F204-V210 HydrophobicContact CZ-CG1 3.77Å; V210-V214 HydrophobicContact CG1-CB 3.35Å; V210-V214 HydrophobicContact CG1-CG1 3.79Å; V210-V214 HydrophobicContact CG1-CG2 3.36Å; V210-A233 WeakPolarHBondContact O-CB 3.5Å
211	T	80.1	Confident	89.9	Confident	48 Å²	48	30.6 Å²	30.6	29%	0.294	16%	0.162	S	C	.	.			trans	-68.5	160.5	174.9	63.5	0	0	0	0	109.5	N186 E213 V214	N186-T211 WeakPolarHBondContact ND2-CG2 3.5Å; N186-T211 PolarHBondContact ND2-OG1 2.76Å; T211-E213 PolarHBondContact O-N 3.01Å; T211-V214 PolarHBondContact O-N 2.87Å; T211-V214 VanDerWaalsContact O-N 3.16Å
212	G	79.6	Confident	89.9	Confident	3 Å²	3	34.9 Å²	34.9	3%	0.031	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.4	179.7	0	0	0	0	0	115.4	V214 L215 L216 L234 V238	G212-V214 PolarHBondContact O-N 2.79Å; G212-L215 PolarHBondContact O-N 3.3Å; G212-L216 PolarHBondContact O-N 3.26Å; G212-L216 VanDerWaalsContact O-N 3.09Å; G212-L234 VanDerWaalsContact N-CD2 3.33Å; G212-V238 VanDerWaalsContact C-CG1 3.47Å; G212-V238 WeakPolarHBondContact O-CG1 3.4Å
213	E	83.8	Confident	89.9	Confident	109 Å²	109	34.9 Å²	34.9	51%	0.509	18%	0.181	S	C	.	.	H	α-helix	trans	-56	-32.9	173	-61.2	-174.2	147.3	0	0	112.9	T211 L215 L216 S217	T211-E213 PolarHBondContact O-N 3.01Å; E213-L215 VanDerWaalsContact C-N 3.32Å; E213-L215 PolarHBondContact O-N 3.02Å; E213-L216 WeakPolarHBondContact O-CB 3.14Å; E213-L216 PolarHBondContact O-N 3.15Å; E213-S217 PolarHBondContact O-N 3.11Å
214	V	90	Very high	89.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.2	-43	175.3	168.3	0	0	0	0	111.2	N186 V189 S190 F193 V210 T211 G212 L216 S217	N186-V214 HydrophobicContact CB-CG2 4.07Å; V189-V214 HydrophobicContact CB-CG1 4.24Å; V189-V214 HydrophobicContact CB-CG2 4.11Å; V189-V214 HydrophobicContact CG1-CG1 3.53Å; V189-V214 HydrophobicContact CG1-CG2 4.23Å; S190-V214 WeakPolarHBondContact OG-CA 3.35Å; S190-V214 WeakPolarHBondContact OG-CG2 3.34Å; F193-V214 HydrophobicContact CD2-CG1 3.55Å; F193-V214 HydrophobicContact CE2-CG1 3.61Å; F193-V214 HydrophobicContact CG-CG1 4.07Å; F193-V214 HydrophobicContact CZ-CG1 4.24Å; V210-V214 HydrophobicContact CG1-CB 3.35Å; V210-V214 HydrophobicContact CG1-CG1 3.79Å; V210-V214 HydrophobicContact CG1-CG2 3.36Å; T211-V214 PolarHBondContact O-N 2.87Å; T211-V214 VanDerWaalsContact O-N 3.16Å; G212-V214 PolarHBondContact O-N 2.79Å; V214-L216 VanDerWaalsContact C-N 3.29Å; V214-L216 PolarHBondContact O-N 3.03Å; V214-S217 PolarHBondContact O-N 3.34Å; V214-S217 PolarHBondContact O-OG 3.2Å
215	L	93	Very high	90.1	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-72.1	-25	178.2	-62.6	-179.2	0	0	0	111.9	F193 L202 F204 G212 E213 S217 L218 K220 L228 L234 I242	F193-L215 HydrophobicContact CE1-CD2 4.03Å; F193-L215 HydrophobicContact CZ-CD2 4.46Å; L202-L215 HydrophobicContact CD2-CD2 3.89Å; F204-L215 HydrophobicContact CD1-CD1 3.84Å; F204-L215 HydrophobicContact CD1-CD2 4.26Å; F204-L215 HydrophobicContact CD1-CG 4.4Å; F204-L215 HydrophobicContact CD2-CD2 4.25Å; F204-L215 HydrophobicContact CE1-CD1 4.07Å; F204-L215 HydrophobicContact CE1-CD2 4.47Å; F204-L215 HydrophobicContact CE1-CG 4.37Å; F204-L215 HydrophobicContact CE2-CD2 4.45Å; F204-L215 HydrophobicContact CG-CD1 4.44Å; F204-L215 HydrophobicContact CG-CD2 4.14Å; G212-L215 PolarHBondContact O-N 3.3Å; E213-L215 VanDerWaalsContact C-N 3.32Å; E213-L215 PolarHBondContact O-N 3.02Å; L215-S217 PolarHBondContact O-N 3.08Å; L215-L218 WeakPolarHBondContact O-CB 3.41Å; L215-L218 PolarHBondContact O-N 3.01Å; L215-K220 WeakPolarHBondContact O-CE 3.1Å; L215-K220 PolarHBondContact O-NZ 2.87Å; L215-L228 HydrophobicContact CD1-CD2 3.83Å; L215-L234 HydrophobicContact CD1-CD1 3.89Å; L215-L234 HydrophobicContact CD1-CD2 4.03Å; L215-I242 HydrophobicContact CB-CD1 3.43Å; L215-I242 VanDerWaalsContact CB-CD1 3.43Å; L215-I242 HydrophobicContact CB-CG1 4.07Å; L215-I242 HydrophobicContact CD1-CD1 3.85Å; L215-I242 HydrophobicContact CG-CD1 4.3Å
216	L	94.1	Very high	90.4	Very high	62 Å²	62	36.7 Å²	36.7	33%	0.325	19%	0.189	S	C	.	.	H	α-helix	trans	-61.7	-33.8	171.9	-65.6	-179.8	0	0	0	112.1	G212 E213 V214 L218 K220 V238 V241 I242	G212-L216 PolarHBondContact O-N 3.26Å; G212-L216 VanDerWaalsContact O-N 3.09Å; E213-L216 WeakPolarHBondContact O-CB 3.14Å; E213-L216 PolarHBondContact O-N 3.15Å; V214-L216 VanDerWaalsContact C-N 3.29Å; V214-L216 PolarHBondContact O-N 3.03Å; L216-L218 VanDerWaalsContact C-N 3.31Å; L216-L218 PolarHBondContact O-N 2.89Å; L216-K220 PolarHBondContact O-NZ 3.04Å; L216-V238 HydrophobicContact CD1-CG1 4.16Å; L216-V238 HydrophobicContact CD2-CG1 4.03Å; L216-V238 HydrophobicContact CG-CG1 3.91Å; L216-V241 HydrophobicContact CD2-CB 3.88Å; L216-V241 HydrophobicContact CD2-CG1 3.43Å; L216-V241 VanDerWaalsContact CD2-CG1 3.43Å; L216-I242 HydrophobicContact CD2-CG1 3.95Å
217	S	95.3	Very high	90.7	Very high	35 Å²	35	35.1 Å²	35.1	25%	0.245	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.2	178.8	74.5	0	0	0	0	115.3	S190 S194 E213 V214 L215	S190-S217 VanDerWaalsContact C-OG 3.29Å; S190-S217 WeakPolarHBondContact CA-OG 3.21Å; S190-S217 WeakPolarHBondContact CB-OG 3.46Å; S190-S217 WeakPolarHBondContact O-CB 3.39Å; S190-S217 PolarHBondContact O-OG 3.23Å; S194-S217 VanDerWaalsContact CA-O 3.29Å; S194-S217 WeakPolarHBondContact CA-O 3.04Å; S194-S217 WeakPolarHBondContact CB-O 3.41Å; E213-S217 PolarHBondContact O-N 3.11Å; V214-S217 PolarHBondContact O-N 3.34Å; V214-S217 PolarHBondContact O-OG 3.2Å; L215-S217 PolarHBondContact O-N 3.08Å
218	L	95.7	Very high	91	Very high	7 Å²	7	34.9 Å²	34.9	4%	0.037	18%	0.179	C	C	.	.	S	Bend	trans	-67.9	133.4	179.4	178.8	66.8	0	0	0	110.7	F193 L196 L199 L202 L215 L216 K220 L223	F193-L218 HydrophobicContact CB-CB 4.49Å; F193-L218 HydrophobicContact CD1-CB 4.02Å; F193-L218 HydrophobicContact CD1-CD1 3.75Å; F193-L218 HydrophobicContact CD1-CD2 4.47Å; F193-L218 HydrophobicContact CD1-CG 4.27Å; L196-L218 HydrophobicContact CB-CD1 4.19Å; L199-L218 HydrophobicContact CB-CD1 4.42Å; L199-L218 HydrophobicContact CD2-CD1 3.57Å; L199-L218 HydrophobicContact CD2-CD2 4.17Å; L199-L218 HydrophobicContact CD2-CG 4.5Å; L202-L218 HydrophobicContact CD2-CD2 3.68Å; L215-L218 WeakPolarHBondContact O-CB 3.41Å; L215-L218 PolarHBondContact O-N 3.01Å; L216-L218 VanDerWaalsContact C-N 3.31Å; L216-L218 PolarHBondContact O-N 2.89Å; L218-K220 HydrophobicContact CD2-CG 4.49Å; L218-K220 HydrophobicContact CG-CG 4.46Å; L218-K220 WeakPolarHBondContact O-CG 3.48Å; L218-K220 PolarHBondContact O-N 3.48Å; L218-K220 PolarHBondContact O-NZ 2.82Å; L218-L223 HydrophobicContact CD2-CD2 4.44Å
219	P	96	Very high	91.2	Very high	38 Å²	38	33.2 Å²	33.2	25%	0.247	17%	0.17	C	C	.	.			trans	-67.1	122.6	166	-18.7	33.7	0	0	0	110	F193	F193-P219 VanDerWaalsContact O-CD 3.3Å; F193-P219 WeakPolarHBondContact O-CD 3.34Å
220	K	95.3	Very high	91.7	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.026	18%	0.181	C	C	.	.			trans	-111.1	-2.6	-170.6	-66.1	162.9	-160.7	80.9	0	114.2	L215 L216 L218 H222 L223 I242 Q245	L215-K220 WeakPolarHBondContact O-CE 3.1Å; L215-K220 PolarHBondContact O-NZ 2.87Å; L216-K220 PolarHBondContact O-NZ 3.04Å; L218-K220 HydrophobicContact CD2-CG 4.49Å; L218-K220 HydrophobicContact CG-CG 4.46Å; L218-K220 WeakPolarHBondContact O-CG 3.48Å; L218-K220 PolarHBondContact O-N 3.48Å; L218-K220 PolarHBondContact O-NZ 2.82Å; K220-H222 PolarHBondContact O-N 3.47Å; K220-H222 VanDerWaalsContact O-N 3.16Å; K220-L223 PolarHBondContact O-N 2.76Å; K220-L223 VanDerWaalsContact O-N 3.13Å; K220-I242 HydrophobicContact CD-CG2 4.19Å; K220-Q245 HydrophobicContact CB-CB 4.2Å; K220-Q245 WeakPolarHBondContact CB-O 3.32Å; K220-Q245 HydrophobicContact CD-CB 3.52Å; K220-Q245 HydrophobicContact CG-CB 4.5Å
221	D	94.8	Very high	91.6	Very high	83 Å²	83	35.9 Å²	35.9	44%	0.444	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-32.2	-176.7	-69	-43.2	0	0	0	112.5	S248	D221-S248 WeakPolarHBondContact O-CB 3.49Å; D221-S248 PolarHBondContact O-OG 2.46Å
222	H	97.2	Very high	91.3	Very high	102 Å²	102	36.8 Å²	36.8	47%	0.472	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-0	-178.5	-59.9	-60.6	0	0	0	114.1	S197 L199 R200 K220 E224	S197-H222 PolarHBondContact O-CD2 2.87Å; L199-H222 CarbonylContact O-C 3.35Å; R200-H222 WeakPolarHBondContact CA-O 3.38Å; K220-H222 PolarHBondContact O-N 3.47Å; K220-H222 VanDerWaalsContact O-N 3.16Å; H222-E224 PolarHBondContact O-N 2.86Å
223	L	98.1	Very high	90.9	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.196	C	C	.	.			trans	-71.6	115.5	-175.9	-162.8	71.1	0	0	0	110	L199 L202 L218 K220 L226 S248 L249	L199-L223 HydrophobicContact CD2-CD1 4.5Å; L199-L223 HydrophobicContact CG-CD1 4.49Å; L202-L223 HydrophobicContact CB-CD1 3.99Å; L218-L223 HydrophobicContact CD2-CD2 4.44Å; K220-L223 PolarHBondContact O-N 2.76Å; K220-L223 VanDerWaalsContact O-N 3.13Å; L223-L226 HydrophobicContact CD2-CB 4.08Å; L223-L226 HydrophobicContact CD2-CD1 4.17Å; L223-L226 HydrophobicContact CD2-CD2 4.3Å; L223-L226 HydrophobicContact CD2-CG 4.41Å; L223-S248 CarbonylContact O-C 3.57Å; L223-L249 WeakPolarHBondContact O-CA 3.4Å; L223-L249 PolarHBondContact O-N 3.05Å
224	E	98.4	Very high	90.6	Very high	36 Å²	36	33.2 Å²	33.2	17%	0.168	17%	0.174	C	C	.	.			trans	-101.7	-32.9	-179	-67.9	-177.2	-146.9	0	0	112.3	R200 H222 S248 K250 K251	R200-E224 IonicContact CZ-OE1 2.91Å; R200-E224 IonicContact CZ-OE2 3.39Å; R200-E224 IonicContact NE-OE1 3.61Å; R200-E224 PolarHBondContact NE-OE1 2.68Å; R200-E224 IonicContact NH2-OE1 2.62Å; R200-E224 PolarHBondContact NH2-OE1 3.47Å; R200-E224 IonicContact NH2-OE2 3.26Å; R200-E224 PolarHBondContact NH2-OE2 3.08Å; R200-E224 WeakPolarHBondContact O-CA 3.32Å; R200-E224 PolarHBondContact O-N 2.74Å; H222-E224 PolarHBondContact O-N 2.86Å; E224-S248 WeakPolarHBondContact CA-O 3.36Å; E224-K250 HydrophobicContact CB-CD 4.47Å; E224-K250 HydrophobicContact CG-CD 4.46Å; E224-K250 WeakPolarHBondContact O-CA 3.02Å; E224-K250 PolarHBondContact O-N 3.27Å; E224-K250 IonicContact OE1-NZ 2.76Å; E224-K250 IonicContact OE2-NZ 3.45Å; E224-K250 PolarHBondContact OE2-NZ 2.81Å; E224-K251 PolarHBondContact O-N 2.84Å
225	E	98.4	Very high	90.2	Very high	38 Å²	38	39 Å²	39	18%	0.178	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.7	178.6	-47.9	-167.9	-174.7	0	0	111	R200 V201 L202 Y227 K251	R200-E225 PolarHBondContact O-N 2.9Å; V201-E225 WeakPolarHBondContact CA-O 3.17Å; V201-E225 HydrophobicContact CB-CB 4.4Å; V201-E225 HydrophobicContact CG1-CB 4.13Å; V201-E225 HydrophobicContact CG2-CB 4.07Å; V201-E225 HydrophobicContact CG2-CG 4.02Å; L202-E225 PolarHBondContact N-O 2.69Å; E225-Y227 HydrophobicContact CB-CD2 4.48Å; E225-Y227 HydrophobicContact CB-CE2 3.71Å; E225-Y227 PolarHBondContact OE2-OH 2.65Å; E225-K251 WeakPolarHBondContact CA-O 3.41Å; E225-K251 HydrophobicContact CB-CB 4.13Å; E225-K251 VanDerWaalsContact CD-NZ 3.34Å; E225-K251 HydrophobicContact CG-CB 3.94Å; E225-K251 HydrophobicContact CG-CD 4.15Å; E225-K251 HydrophobicContact CG-CG 4.01Å; E225-K251 VanDerWaalsContact OE1-CE 3.32Å; E225-K251 WeakPolarHBondContact OE1-CE 3.24Å; E225-K251 IonicContact OE1-NZ 3.8Å; E225-K251 PolarHBondContact OE1-NZ 3.32Å; E225-K251 IonicContact OE2-NZ 2.75Å; E225-K251 PolarHBondContact OE2-NZ 3.41Å
226	L	97.3	Very high	89.7	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.2	179.6	178.4	58.9	0	0	0	110	L202 L223 L228 I242 L243 L249 K251 L252 N253	L202-L226 HydrophobicContact CB-CD1 4.31Å; L202-L226 HydrophobicContact CD2-CD1 4.15Å; L202-L226 HydrophobicContact CG-CD1 4.38Å; L223-L226 HydrophobicContact CD2-CB 4.08Å; L223-L226 HydrophobicContact CD2-CD1 4.17Å; L223-L226 HydrophobicContact CD2-CD2 4.3Å; L223-L226 HydrophobicContact CD2-CG 4.41Å; L226-L228 HydrophobicContact CD1-CD1 4.35Å; L226-L228 HydrophobicContact CD1-CD2 3.86Å; L226-L228 HydrophobicContact CD1-CG 3.86Å; L226-L228 HydrophobicContact CD2-CD1 4.05Å; L226-L228 HydrophobicContact CD2-CG 4.34Å; L226-L228 HydrophobicContact CG-CD1 4.23Å; L226-L228 HydrophobicContact CG-CG 3.95Å; L226-I242 HydrophobicContact CD2-CG2 4.12Å; L226-L243 HydrophobicContact CD2-CD2 4.03Å; L226-L249 HydrophobicContact CB-CD1 3.76Å; L226-K251 PolarHBondContact N-O 2.89Å; L226-K251 VanDerWaalsContact N-O 3.07Å; L226-L252 HydrophobicContact CB-CD1 4.38Å; L226-L252 HydrophobicContact CD2-CD1 4.4Å; L226-L252 HydrophobicContact CG-CD1 4.45Å; L226-L252 WeakPolarHBondContact O-CA 3.31Å; L226-N253 PolarHBondContact O-N 2.94Å
227	Y	96.1	Very high	89.2	Confident	40 Å²	40	39.4 Å²	39.4	16%	0.157	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	112.2	176.4	-56.1	-109.4	0	0	0	108.4	L202 H203 F204 E225 N253	L202-Y227 PolarHBondContact O-N 3Å; H203-Y227 AromaticContact CD2-CD2 3.32Å; H203-Y227 WeakPolarHBondContact CD2-CD2 3.3Å; H203-Y227 AromaticContact CD2-CE2 3.68Å; H203-Y227 AromaticContact CD2-CG 3.96Å; H203-Y227 AromaticContact CE1-CD1 3.61Å; H203-Y227 AromaticContact CE1-CD2 3.38Å; H203-Y227 WeakPolarHBondContact CE1-CD2 3.47Å; H203-Y227 AromaticContact CE1-CE1 3.75Å; H203-Y227 AromaticContact CE1-CE2 3.5Å; H203-Y227 AromaticContact CE1-CG 3.46Å; H203-Y227 VanDerWaalsContact CE1-CG 3.46Å; H203-Y227 AromaticContact CE1-CZ 3.69Å; H203-Y227 AromaticContact CG-CD2 3.73Å; H203-Y227 AromaticContact CG-CG 3.9Å; H203-Y227 AromaticContact ND1-CD2 3.77Å; H203-Y227 AromaticContact ND1-CG 3.61Å; H203-Y227 AromaticContact NE2-CD2 3.1Å; H203-Y227 WeakPolarHBondContact NE2-CD2 3.5Å; H203-Y227 AromaticContact NE2-CE2 3.02Å; H203-Y227 WeakPolarHBondContact NE2-CE2 3.44Å; H203-Y227 AromaticContact NE2-CG 3.71Å; H203-Y227 AromaticContact NE2-CZ 3.58Å; F204-Y227 CarbonylContact C-O 3.37Å; F204-Y227 PolarHBondContact N-O 3.08Å; E225-Y227 HydrophobicContact CB-CD2 4.48Å; E225-Y227 HydrophobicContact CB-CE2 3.71Å; E225-Y227 PolarHBondContact OE2-OH 2.65Å; Y227-N253 WeakPolarHBondContact CA-O 3.45Å; Y227-N253 HydrophobicContact CD1-CB 3.4Å; Y227-N253 VanDerWaalsContact CD1-CB 3.4Å; Y227-N253 HydrophobicContact CE1-CB 4.03Å; Y227-N253 HydrophobicContact CG-CB 4.04Å
228	L	93	Very high	88.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	90.9	176.4	-60.7	177.3	0	0	0	107.9	F204 L215 L226 W231 L234 V239 N253 L254 C255	F204-L228 HydrophobicContact CB-CD2 3.95Å; F204-L228 HydrophobicContact CD1-CD2 4.1Å; F204-L228 HydrophobicContact CG-CD2 4.48Å; L215-L228 HydrophobicContact CD1-CD2 3.83Å; L226-L228 HydrophobicContact CD1-CD1 4.35Å; L226-L228 HydrophobicContact CD1-CD2 3.86Å; L226-L228 HydrophobicContact CD1-CG 3.86Å; L226-L228 HydrophobicContact CD2-CD1 4.05Å; L226-L228 HydrophobicContact CD2-CG 4.34Å; L226-L228 HydrophobicContact CG-CD1 4.23Å; L226-L228 HydrophobicContact CG-CG 3.95Å; L228-W231 PolarHBondContact O-NE1 2.93Å; L228-L234 HydrophobicContact CD1-CD1 4.26Å; L228-L234 HydrophobicContact CD2-CD1 4.29Å; L228-V239 HydrophobicContact CD1-CG1 4.36Å; L228-N253 PolarHBondContact N-O 2.92Å; L228-L254 HydrophobicContact CB-CD2 3.92Å; L228-L254 HydrophobicContact CD1-CD2 4.03Å; L228-L254 HydrophobicContact CG-CD2 4.35Å; L228-C255 PolarHBondContact O-N 2.76Å
229	N	88.1	Confident	88.6	Confident	33 Å²	33	38.4 Å²	38.4	18%	0.176	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.2	178	-62.2	-26.3	0	0	0	113	S205 E206 W231 N253 C255	S205-N229 CarbonylContact C-O 3.18Å; S205-N229 WeakPolarHBondContact CA-O 3.14Å; S205-N229 VanDerWaalsContact CB-O 3.31Å; S205-N229 WeakPolarHBondContact CB-O 3.31Å; S205-N229 WeakPolarHBondContact OG-CB 3.35Å; S205-N229 PolarHBondContact OG-N 3.17Å; E206-N229 PolarHBondContact N-O 3.43Å; N229-W231 PolarHBondContact O-N 2.93Å; N229-N253 PolarHBondContact ND2-ND2 2.89Å; N229-N253 PolarHBondContact OD1-OD1 3.42Å; N229-C255 HydrophobicContact CB-CB 3.7Å; N229-C255 WeakPolarHBondContact OD1-CB 3.43Å; N229-C255 PolarHBondContact OD1-N 3.25Å; N229-C255 VanDerWaalsContact OD1-N 3.11Å
230	K	84	Confident	88.2	Confident	99 Å²	99	39 Å²	39	43%	0.43	20%	0.203	S	C	.	.	S	Bend	trans	55.2	47.4	177.6	-56.3	172.9	-175.5	165.7	0	112.7	E206 T232 C255	E206-K230 HydrophobicContact CG-CB 4.27Å; E206-K230 HydrophobicContact CG-CD 3.89Å; E206-K230 WeakPolarHBondContact OE1-CD 3.37Å; E206-K230 IonicContact OE1-NZ 3.96Å; E206-K230 PolarHBondContact OE1-NZ 2.88Å; K230-T232 VanDerWaalsContact C-N 3.27Å; K230-T232 PolarHBondContact O-N 3.07Å; K230-C255 PolarHBondContact N-O 2.92Å
231	W	75.9	Confident	88.1	Confident	9 Å²	9	41.5 Å²	41.5	3%	0.034	22%	0.219	C	C	.	.			trans	-78.4	61	-174.8	43.1	-94.2	0	0	0	113.9	L228 N229 A233 L234 P236 V239 C255 P257 F267 I270	L228-W231 PolarHBondContact O-NE1 2.93Å; N229-W231 PolarHBondContact O-N 2.93Å; W231-A233 PolarHBondContact O-N 2.99Å; W231-L234 HydrophobicContact CB-CB 4.07Å; W231-L234 HydrophobicContact CB-CD1 3.45Å; W231-L234 VanDerWaalsContact CB-CD1 3.45Å; W231-L234 HydrophobicContact CB-CG 3.65Å; W231-L234 HydrophobicContact CD2-CB 4.09Å; W231-L234 HydrophobicContact CD2-CD1 4.33Å; W231-L234 HydrophobicContact CE3-CB 3.59Å; W231-L234 HydrophobicContact CE3-CG 4.49Å; W231-L234 HydrophobicContact CG-CB 4.33Å; W231-L234 HydrophobicContact CG-CD1 3.87Å; W231-L234 HydrophobicContact CG-CG 4.3Å; W231-L234 HydrophobicContact CZ3-CB 4.38Å; W231-L234 WeakPolarHBondContact CZ3-O 3.37Å; W231-L234 PolarHBondContact O-N 3.34Å; W231-P236 HydrophobicContact CH2-CG 4.3Å; W231-P236 HydrophobicContact CZ3-CG 4.27Å; W231-V239 HydrophobicContact CD2-CG2 4.29Å; W231-V239 HydrophobicContact CE3-CG2 4.25Å; W231-V239 HydrophobicContact CH2-CG2 4.23Å; W231-V239 HydrophobicContact CZ2-CG2 4.28Å; W231-V239 HydrophobicContact CZ3-CG2 4.22Å; W231-C255 VanDerWaalsContact CD1-O 3.3Å; W231-C255 PolarHBondContact NE1-O 2.92Å; W231-C255 VanDerWaalsContact NE1-O 3.15Å; W231-P257 HydrophobicContact CD2-CG 4.24Å; W231-P257 HydrophobicContact CE3-CG 3.82Å; W231-P257 HydrophobicContact CH2-CG 4.35Å; W231-P257 HydrophobicContact CZ3-CG 3.9Å; W231-F267 HydrophobicContact CH2-CE1 4Å; W231-F267 HydrophobicContact CZ3-CE1 4.11Å; W231-I270 HydrophobicContact CH2-CD1 3.98Å; W231-I270 HydrophobicContact CZ2-CD1 4.27Å
232	T	73.3	Confident	88.1	Confident	67 Å²	67	37.8 Å²	37.8	41%	0.411	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-21.5	-173.1	53.5	0	0	0	0	115.9	K230 P257	K230-T232 VanDerWaalsContact C-N 3.27Å; K230-T232 PolarHBondContact O-N 3.07Å; T232-P257 HydrophobicContact CG2-CB 3.96Å
233	A	71.6	Confident	87.9	Confident	29 Å²	29	32.9 Å²	32.9	24%	0.24	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	0.7	-179.7	0	0	0	0	0	115	V210 W231	V210-A233 WeakPolarHBondContact O-CB 3.5Å; W231-A233 PolarHBondContact O-N 2.99Å
234	L	76.8	Confident	87.8	Confident	8 Å²	8	35.6 Å²	35.6	4%	0.042	20%	0.195	C	C	.	.			trans	-92.6	124.6	173.9	-52.5	179.4	0	0	0	109.2	G212 L215 L228 W231 V239	G212-L234 VanDerWaalsContact N-CD2 3.33Å; L215-L234 HydrophobicContact CD1-CD1 3.89Å; L215-L234 HydrophobicContact CD1-CD2 4.03Å; L228-L234 HydrophobicContact CD1-CD1 4.26Å; L228-L234 HydrophobicContact CD2-CD1 4.29Å; W231-L234 HydrophobicContact CB-CB 4.07Å; W231-L234 HydrophobicContact CB-CD1 3.45Å; W231-L234 VanDerWaalsContact CB-CD1 3.45Å; W231-L234 HydrophobicContact CB-CG 3.65Å; W231-L234 HydrophobicContact CD2-CB 4.09Å; W231-L234 HydrophobicContact CD2-CD1 4.33Å; W231-L234 HydrophobicContact CE3-CB 3.59Å; W231-L234 HydrophobicContact CE3-CG 4.49Å; W231-L234 HydrophobicContact CG-CB 4.33Å; W231-L234 HydrophobicContact CG-CD1 3.87Å; W231-L234 HydrophobicContact CG-CG 4.3Å; W231-L234 HydrophobicContact CZ3-CB 4.38Å; W231-L234 WeakPolarHBondContact CZ3-O 3.37Å; W231-L234 PolarHBondContact O-N 3.34Å; L234-V239 HydrophobicContact CB-CG2 3.97Å; L234-V239 HydrophobicContact CD1-CG2 4.09Å
235	E	82.2	Confident	87.7	Confident	123 Å²	123	37.4 Å²	37.4	58%	0.575	20%	0.203	S	C	*	.			trans	-68.8	140.7	165.3	-67	-179.7	-178.4	0	0	109.1	S237 V238 V239	E235-S237 PolarHBondContact O-N 2.84Å; E235-S237 VanDerWaalsContact O-N 3.15Å; E235-S237 PolarHBondContact OE2-OG 3.46Å; E235-V238 HydrophobicContact CB-CG2 4.1Å; E235-V238 WeakPolarHBondContact O-CB 3.49Å; E235-V238 PolarHBondContact O-N 2.95Å; E235-V239 PolarHBondContact O-N 3.3Å
236	P	82.3	Confident	87.6	Confident	14 Å²	14	35.7 Å²	35.7	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-50	-38.6	176	-32	38.1	0	0	0	114	W231 V238 V239 D240 F267 I270	W231-P236 HydrophobicContact CH2-CG 4.3Å; W231-P236 HydrophobicContact CZ3-CG 4.27Å; P236-V238 VanDerWaalsContact C-N 3.29Å; P236-V238 PolarHBondContact O-N 3.23Å; P236-V239 PolarHBondContact O-N 3.17Å; P236-D240 PolarHBondContact O-N 3.09Å; P236-D240 VanDerWaalsContact O-N 3.1Å; P236-F267 HydrophobicContact CG-CD1 3.54Å; P236-F267 HydrophobicContact CG-CE1 3.61Å; P236-F267 HydrophobicContact CG-CG 4.2Å; P236-F267 HydrophobicContact CG-CZ 4.31Å; P236-I270 HydrophobicContact CB-CD1 3.78Å; P236-I270 HydrophobicContact CB-CG1 3.58Å
237	S	84.5	Confident	87.6	Confident	57 Å²	57	42.6 Å²	42.6	40%	0.399	22%	0.221	S	C	.	.	H	α-helix	trans	-59.6	-36.4	175.3	54.8	0	0	0	0	112.7	E235 D240 V241	E235-S237 PolarHBondContact O-N 2.84Å; E235-S237 VanDerWaalsContact O-N 3.15Å; E235-S237 PolarHBondContact OE2-OG 3.46Å; S237-D240 WeakPolarHBondContact O-CB 3.38Å; S237-D240 PolarHBondContact O-N 2.78Å; S237-V241 WeakPolarHBondContact O-CG2 3.47Å; S237-V241 PolarHBondContact O-N 2.76Å; S237-V241 VanDerWaalsContact O-N 3.13Å
238	V	87.7	Confident	87.6	Confident	21 Å²	21	42.5 Å²	42.5	13%	0.127	23%	0.227	C	C	.	.	H	α-helix	trans	-73.6	-37.3	179.6	179.9	0	0	0	0	110.8	G212 L216 E235 P236 D240 V241 I242	G212-V238 VanDerWaalsContact C-CG1 3.47Å; G212-V238 WeakPolarHBondContact O-CG1 3.4Å; L216-V238 HydrophobicContact CD1-CG1 4.16Å; L216-V238 HydrophobicContact CD2-CG1 4.03Å; L216-V238 HydrophobicContact CG-CG1 3.91Å; E235-V238 HydrophobicContact CB-CG2 4.1Å; E235-V238 WeakPolarHBondContact O-CB 3.49Å; E235-V238 PolarHBondContact O-N 2.95Å; P236-V238 VanDerWaalsContact C-N 3.29Å; P236-V238 PolarHBondContact O-N 3.23Å; V238-D240 VanDerWaalsContact C-N 3.29Å; V238-D240 PolarHBondContact O-N 2.75Å; V238-V241 PolarHBondContact O-N 3.32Å; V238-I242 HydrophobicContact CG1-CD1 3.94Å; V238-I242 HydrophobicContact CG1-CG1 4.41Å; V238-I242 WeakPolarHBondContact O-CD1 3.27Å; V238-I242 VanDerWaalsContact O-CG1 3.23Å; V238-I242 WeakPolarHBondContact O-CG1 3.36Å; V238-I242 PolarHBondContact O-N 3.11Å
239	V	89.3	Confident	87.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-43.2	172.7	-179.1	0	0	0	0	110.5	L228 W231 L234 E235 P236 V241 I242 L243 L254 I270	L228-V239 HydrophobicContact CD1-CG1 4.36Å; W231-V239 HydrophobicContact CD2-CG2 4.29Å; W231-V239 HydrophobicContact CE3-CG2 4.25Å; W231-V239 HydrophobicContact CH2-CG2 4.23Å; W231-V239 HydrophobicContact CZ2-CG2 4.28Å; W231-V239 HydrophobicContact CZ3-CG2 4.22Å; L234-V239 HydrophobicContact CB-CG2 3.97Å; L234-V239 HydrophobicContact CD1-CG2 4.09Å; E235-V239 PolarHBondContact O-N 3.3Å; P236-V239 PolarHBondContact O-N 3.17Å; V239-V241 PolarHBondContact O-N 3.42Å; V239-I242 PolarHBondContact O-N 2.86Å; V239-L243 HydrophobicContact CG1-CD1 4.08Å; V239-L243 HydrophobicContact CG1-CG 4.33Å; V239-L243 WeakPolarHBondContact O-CG 3.49Å; V239-L243 PolarHBondContact O-N 2.93Å; V239-L254 HydrophobicContact CG1-CD2 4.44Å; V239-I270 HydrophobicContact CB-CD1 4.31Å; V239-I270 HydrophobicContact CG1-CD1 4.45Å
240	D	89.2	Confident	88.4	Confident	50 Å²	50	44.9 Å²	44.9	27%	0.267	24%	0.235	S	C	.	.	H	α-helix	trans	-56.9	-48.3	175.5	-166.5	46.5	0	0	0	111.8	P236 S237 V238 I242 L243 S244 S275	P236-D240 PolarHBondContact O-N 3.09Å; P236-D240 VanDerWaalsContact O-N 3.1Å; S237-D240 WeakPolarHBondContact O-CB 3.38Å; S237-D240 PolarHBondContact O-N 2.78Å; V238-D240 VanDerWaalsContact C-N 3.29Å; V238-D240 PolarHBondContact O-N 2.75Å; D240-I242 PolarHBondContact O-N 3.06Å; D240-L243 PolarHBondContact O-N 2.97Å; D240-S244 PolarHBondContact O-N 3.14Å; D240-S275 WeakPolarHBondContact OD1-CB 3.45Å; D240-S275 PolarHBondContact OD1-OG 3.16Å
241	V	92.5	Very high	89	Confident	60 Å²	60	43.5 Å²	43.5	36%	0.364	23%	0.229	S	C	.	.	H	α-helix	trans	-62.7	-41	176.6	177.9	0	0	0	0	111.7	L216 S237 V238 V239 S244 Q245	L216-V241 HydrophobicContact CD2-CB 3.88Å; L216-V241 HydrophobicContact CD2-CG1 3.43Å; L216-V241 VanDerWaalsContact CD2-CG1 3.43Å; S237-V241 WeakPolarHBondContact O-CG2 3.47Å; S237-V241 PolarHBondContact O-N 2.76Å; S237-V241 VanDerWaalsContact O-N 3.13Å; V238-V241 PolarHBondContact O-N 3.32Å; V239-V241 PolarHBondContact O-N 3.42Å; V241-S244 PolarHBondContact O-N 3.3Å; V241-S244 PolarHBondContact O-OG 2.76Å; V241-Q245 WeakPolarHBondContact O-CG 3.48Å
242	I	93.5	Very high	90	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-50.4	176.9	-68.4	159.4	0	0	0	110.1	L215 L216 K220 L226 V238 V239 D240 S244 Q245 C246	L215-I242 HydrophobicContact CB-CD1 3.43Å; L215-I242 VanDerWaalsContact CB-CD1 3.43Å; L215-I242 HydrophobicContact CB-CG1 4.07Å; L215-I242 HydrophobicContact CD1-CD1 3.85Å; L215-I242 HydrophobicContact CG-CD1 4.3Å; L216-I242 HydrophobicContact CD2-CG1 3.95Å; K220-I242 HydrophobicContact CD-CG2 4.19Å; L226-I242 HydrophobicContact CD2-CG2 4.12Å; V238-I242 HydrophobicContact CG1-CD1 3.94Å; V238-I242 HydrophobicContact CG1-CG1 4.41Å; V238-I242 WeakPolarHBondContact O-CD1 3.27Å; V238-I242 VanDerWaalsContact O-CG1 3.23Å; V238-I242 WeakPolarHBondContact O-CG1 3.36Å; V238-I242 PolarHBondContact O-N 3.11Å; V239-I242 PolarHBondContact O-N 2.86Å; D240-I242 PolarHBondContact O-N 3.06Å; I242-S244 VanDerWaalsContact C-N 3.29Å; I242-S244 PolarHBondContact O-N 2.94Å; I242-Q245 PolarHBondContact O-N 3.11Å; I242-Q245 VanDerWaalsContact O-N 3.12Å; I242-C246 PolarHBondContact O-N 3.27Å; I242-C246 PolarHBondContact O-SG 3.31Å
243	L	94.8	Very high	91.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-36.6	-178.9	-66.7	178.7	0	0	0	112	L226 V239 D240 Q245 C246 L249 L252 L254 L272 S275 L276 P277	L226-L243 HydrophobicContact CD2-CD2 4.03Å; V239-L243 HydrophobicContact CG1-CD1 4.08Å; V239-L243 HydrophobicContact CG1-CG 4.33Å; V239-L243 WeakPolarHBondContact O-CG 3.49Å; V239-L243 PolarHBondContact O-N 2.93Å; D240-L243 PolarHBondContact O-N 2.97Å; L243-Q245 PolarHBondContact O-N 3.36Å; L243-C246 PolarHBondContact O-N 3.19Å; L243-L249 HydrophobicContact CD2-CD2 4.25Å; L243-L252 HydrophobicContact CD1-CD2 4.5Å; L243-L252 HydrophobicContact CD2-CD1 3.89Å; L243-L252 HydrophobicContact CD2-CD2 4.11Å; L243-L254 HydrophobicContact CD1-CD1 4.36Å; L243-L272 HydrophobicContact CD1-CD2 3.95Å; L243-S275 CarbonylContact C-O 3.19Å; L243-S275 VanDerWaalsContact O-O 3.11Å; L243-L276 HydrophobicContact CB-CD2 4.11Å; L243-L276 HydrophobicContact CD2-CD2 4.15Å; L243-P277 VanDerWaalsContact O-CD 3.24Å; L243-P277 WeakPolarHBondContact O-CD 3.45Å
244	S	95	Very high	92.1	Very high	57 Å²	57	39.3 Å²	39.3	40%	0.399	20%	0.201	S	C	.	.	H	α-helix	trans	-57.5	-19.2	175.5	81	0	0	0	0	115.1	D240 V241 I242 S275	D240-S244 PolarHBondContact O-N 3.14Å; V241-S244 PolarHBondContact O-N 3.3Å; V241-S244 PolarHBondContact O-OG 2.76Å; I242-S244 VanDerWaalsContact C-N 3.29Å; I242-S244 PolarHBondContact O-N 2.94Å; S244-S275 WeakPolarHBondContact CA-O 2.96Å; S244-S275 PolarHBondContact N-O 2.78Å
245	Q	95.7	Very high	92.7	Very high	75 Å²	75	39.4 Å²	39.4	35%	0.35	20%	0.202	S	C	.	.	H	α-helix	trans	-106	-10.4	-177.2	-65.5	173.4	3.4	0	0	112.8	K220 V241 I242 L243 R247	K220-Q245 HydrophobicContact CB-CB 4.2Å; K220-Q245 WeakPolarHBondContact CB-O 3.32Å; K220-Q245 HydrophobicContact CD-CB 3.52Å; K220-Q245 HydrophobicContact CG-CB 4.5Å; V241-Q245 WeakPolarHBondContact O-CG 3.48Å; I242-Q245 PolarHBondContact O-N 3.11Å; I242-Q245 VanDerWaalsContact O-N 3.12Å; L243-Q245 PolarHBondContact O-N 3.36Å; Q245-R247 PolarHBondContact O-N 2.74Å; Q245-R247 VanDerWaalsContact O-N 3.1Å
246	C	96.7	Very high	92.6	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	18%	0.175	C	C	.	.			trans	-83.8	81.3	-177.6	-66.6	0	0	0	0	112	I242 L243 S248 L249 P277	I242-C246 PolarHBondContact O-N 3.27Å; I242-C246 PolarHBondContact O-SG 3.31Å; L243-C246 PolarHBondContact O-N 3.19Å; C246-S248 VanDerWaalsContact C-N 3.35Å; C246-S248 PolarHBondContact O-N 3.08Å; C246-L249 HydrophobicContact CB-CB 4.11Å; C246-L249 HydrophobicContact CB-CD1 4.41Å; C246-L249 HydrophobicContact CB-CD2 4.33Å; C246-P277 WeakPolarHBondContact O-CG 3.37Å
247	R	96.9	Very high	92.2	Very high	148 Å²	148	33 Å²	33	56%	0.558	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-21.6	-174.7	-66.3	178.2	178.3	-176.2	0.4	115.4	Q245 P277 N278	Q245-R247 PolarHBondContact O-N 2.74Å; Q245-R247 VanDerWaalsContact O-N 3.1Å; R247-P277 HydrophobicContact CG-CB 4.43Å; R247-P277 HydrophobicContact CG-CG 4.03Å; R247-N278 PolarHBondContact O-ND2 2.84Å
248	S	97.8	Very high	91.6	Very high	38 Å²	38	32.1 Å²	32.1	27%	0.266	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	12.1	-173.2	-62.9	0	0	0	0	113.5	D221 L223 E224 C246 K250	D221-S248 WeakPolarHBondContact O-CB 3.49Å; D221-S248 PolarHBondContact O-OG 2.46Å; L223-S248 CarbonylContact O-C 3.57Å; E224-S248 WeakPolarHBondContact CA-O 3.36Å; C246-S248 VanDerWaalsContact C-N 3.35Å; C246-S248 PolarHBondContact O-N 3.08Å; S248-K250 PolarHBondContact O-N 2.73Å
249	L	98	Very high	90.5	Very high	5 Å²	5	43 Å²	43	3%	0.026	21%	0.21	C	C	.	.			trans	-67.3	124.8	-169.4	-158.2	70.2	0	0	0	112	L223 L226 L243 C246 L252 L276 L282	L223-L249 WeakPolarHBondContact O-CA 3.4Å; L223-L249 PolarHBondContact O-N 3.05Å; L226-L249 HydrophobicContact CB-CD1 3.76Å; L243-L249 HydrophobicContact CD2-CD2 4.25Å; C246-L249 HydrophobicContact CB-CB 4.11Å; C246-L249 HydrophobicContact CB-CD1 4.41Å; C246-L249 HydrophobicContact CB-CD2 4.33Å; L249-L252 HydrophobicContact CD2-CB 3.98Å; L249-L252 HydrophobicContact CD2-CD1 4.15Å; L249-L252 HydrophobicContact CD2-CD2 4.19Å; L249-L252 HydrophobicContact CD2-CG 4.33Å; L249-L276 HydrophobicContact CD2-CD2 3.78Å; L249-L282 HydrophobicContact CG-CD1 4.49Å
250	K	98.2	Very high	89.2	Confident	77 Å²	77	44.6 Å²	44.6	34%	0.335	22%	0.22	S	C	.	.			trans	-115.3	-30.5	178.6	-63.9	173.8	-170.9	164.2	0	112.3	E224 S248 K283 S284	E224-K250 HydrophobicContact CB-CD 4.47Å; E224-K250 HydrophobicContact CG-CD 4.46Å; E224-K250 WeakPolarHBondContact O-CA 3.02Å; E224-K250 PolarHBondContact O-N 3.27Å; E224-K250 IonicContact OE1-NZ 2.76Å; E224-K250 IonicContact OE2-NZ 3.45Å; E224-K250 PolarHBondContact OE2-NZ 2.81Å; S248-K250 PolarHBondContact O-N 2.73Å; K250-K283 PolarHBondContact O-N 3.13Å; K250-S284 PolarHBondContact O-N 3.01Å; K250-S284 VanDerWaalsContact O-N 3.09Å
251	K	98.3	Very high	87.8	Confident	70 Å²	70	50.6 Å²	50.6	30%	0.304	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.6	174.4	-53.7	-164.8	-167.1	141.5	0	110.9	E224 E225 L226 S284	E224-K251 PolarHBondContact O-N 2.84Å; E225-K251 WeakPolarHBondContact CA-O 3.41Å; E225-K251 HydrophobicContact CB-CB 4.13Å; E225-K251 VanDerWaalsContact CD-NZ 3.34Å; E225-K251 HydrophobicContact CG-CB 3.94Å; E225-K251 HydrophobicContact CG-CD 4.15Å; E225-K251 HydrophobicContact CG-CG 4.01Å; E225-K251 VanDerWaalsContact OE1-CE 3.32Å; E225-K251 WeakPolarHBondContact OE1-CE 3.24Å; E225-K251 IonicContact OE1-NZ 3.8Å; E225-K251 PolarHBondContact OE1-NZ 3.32Å; E225-K251 IonicContact OE2-NZ 2.75Å; E225-K251 PolarHBondContact OE2-NZ 3.41Å; L226-K251 PolarHBondContact N-O 2.89Å; L226-K251 VanDerWaalsContact N-O 3.07Å; K251-S284 WeakPolarHBondContact CA-O 3.33Å
252	L	96.8	Very high	86.3	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	118.2	179	176.7	57.9	0	0	0	109.1	L226 L243 L249 L254 L272 L276 L282 S284 F285 E286	L226-L252 HydrophobicContact CB-CD1 4.38Å; L226-L252 HydrophobicContact CD2-CD1 4.4Å; L226-L252 HydrophobicContact CG-CD1 4.45Å; L226-L252 WeakPolarHBondContact O-CA 3.31Å; L243-L252 HydrophobicContact CD1-CD2 4.5Å; L243-L252 HydrophobicContact CD2-CD1 3.89Å; L243-L252 HydrophobicContact CD2-CD2 4.11Å; L249-L252 HydrophobicContact CD2-CB 3.98Å; L249-L252 HydrophobicContact CD2-CD1 4.15Å; L249-L252 HydrophobicContact CD2-CD2 4.19Å; L249-L252 HydrophobicContact CD2-CG 4.33Å; L252-L254 HydrophobicContact CD1-CD1 4.18Å; L252-L254 HydrophobicContact CD1-CD2 3.75Å; L252-L254 HydrophobicContact CD1-CG 3.7Å; L252-L254 HydrophobicContact CD2-CD1 4.04Å; L252-L254 HydrophobicContact CD2-CG 4.35Å; L252-L254 HydrophobicContact CG-CD1 4.17Å; L252-L254 HydrophobicContact CG-CG 3.92Å; L252-L272 HydrophobicContact CD2-CD2 4.11Å; L252-L276 HydrophobicContact CD2-CD1 4.44Å; L252-L282 HydrophobicContact CB-CD1 3.87Å; L252-S284 PolarHBondContact N-O 3.08Å; L252-F285 HydrophobicContact CB-CD2 4.14Å; L252-F285 HydrophobicContact CD2-CD2 4.1Å; L252-F285 HydrophobicContact CD2-CE2 3.89Å; L252-F285 HydrophobicContact CG-CD2 4.15Å; L252-F285 HydrophobicContact CG-CE2 4.14Å; L252-F285 WeakPolarHBondContact O-CA 3.11Å; L252-E286 PolarHBondContact O-N 3.01Å
253	N	95.7	Very high	85	Confident	10 Å²	10	56 Å²	56	5%	0.053	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.6	169.3	-174.7	-22.7	0	0	0	109	L226 Y227 L228 N229 E286	L226-N253 PolarHBondContact O-N 2.94Å; Y227-N253 WeakPolarHBondContact CA-O 3.45Å; Y227-N253 HydrophobicContact CD1-CB 3.4Å; Y227-N253 VanDerWaalsContact CD1-CB 3.4Å; Y227-N253 HydrophobicContact CE1-CB 4.03Å; Y227-N253 HydrophobicContact CG-CB 4.04Å; L228-N253 PolarHBondContact N-O 2.92Å; N229-N253 PolarHBondContact ND2-ND2 2.89Å; N229-N253 PolarHBondContact OD1-OD1 3.42Å; N253-E286 CarbonylContact C-O 3.19Å; N253-E286 WeakPolarHBondContact CA-O 3.31Å; N253-E286 HydrophobicContact CB-CB 4.06Å; N253-E286 PolarHBondContact ND2-OE2 3.31Å
254	L	92.4	Very high	83.5	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	115.3	177.3	-65.5	179	0	0	0	109.3	L228 V239 L243 L252 L272 E286 F287 H288	L228-L254 HydrophobicContact CB-CD2 3.92Å; L228-L254 HydrophobicContact CD1-CD2 4.03Å; L228-L254 HydrophobicContact CG-CD2 4.35Å; V239-L254 HydrophobicContact CG1-CD2 4.44Å; L243-L254 HydrophobicContact CD1-CD1 4.36Å; L252-L254 HydrophobicContact CD1-CD1 4.18Å; L252-L254 HydrophobicContact CD1-CD2 3.75Å; L252-L254 HydrophobicContact CD1-CG 3.7Å; L252-L254 HydrophobicContact CD2-CD1 4.04Å; L252-L254 HydrophobicContact CD2-CG 4.35Å; L252-L254 HydrophobicContact CG-CD1 4.17Å; L252-L254 HydrophobicContact CG-CG 3.92Å; L254-L272 HydrophobicContact CD1-CD1 4.46Å; L254-L272 HydrophobicContact CD1-CD2 3.77Å; L254-E286 PolarHBondContact N-O 2.95Å; L254-F287 HydrophobicContact CB-CD2 4Å; L254-F287 CarbonylContact O-C 3.06Å; L254-F287 VanDerWaalsContact O-CA 3.31Å; L254-F287 WeakPolarHBondContact O-CA 3.34Å; L254-H288 PolarHBondContact O-N 3.24Å
255	C	89.2	Confident	82.1	Confident	9 Å²	9	61.3 Å²	61.3	6%	0.061	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.3	168.8	176.8	0	0	0	0	109.3	L228 N229 K230 W231 H288	L228-C255 PolarHBondContact O-N 2.76Å; N229-C255 HydrophobicContact CB-CB 3.7Å; N229-C255 WeakPolarHBondContact OD1-CB 3.43Å; N229-C255 PolarHBondContact OD1-N 3.25Å; N229-C255 VanDerWaalsContact OD1-N 3.11Å; K230-C255 PolarHBondContact N-O 2.92Å; W231-C255 VanDerWaalsContact CD1-O 3.3Å; W231-C255 PolarHBondContact NE1-O 2.92Å; W231-C255 VanDerWaalsContact NE1-O 3.15Å; C255-H288 CarbonylContact C-O 3.49Å; C255-H288 WeakPolarHBondContact CA-O 3.31Å; C255-H288 HydrophobicContact CB-CB 3.78Å
256	S	80.8	Confident	80.6	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.014	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-50.7	142.1	177.2	63.3	0	0	0	0	110.7	G258 H288 D289 F290	S256-G258 PolarHBondContact O-N 3.01Å; S256-H288 PolarHBondContact N-O 3.08Å; S256-H288 PolarHBondContact OG-O 3.11Å; S256-D289 WeakPolarHBondContact OG-CA 3.31Å; S256-F290 PolarHBondContact OG-N 3.15Å
257	P	74.1	Confident	78.8	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.013	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-61.2	122.4	169.2	27.4	-33.7	0	0	0	108.2	W231 T232 V260 F267	W231-P257 HydrophobicContact CD2-CG 4.24Å; W231-P257 HydrophobicContact CE3-CG 3.82Å; W231-P257 HydrophobicContact CH2-CG 4.35Å; W231-P257 HydrophobicContact CZ3-CG 3.9Å; T232-P257 HydrophobicContact CG2-CB 3.96Å; P257-V260 HydrophobicContact CB-CG2 3.58Å; P257-V260 HydrophobicContact CG-CG2 3.53Å; P257-V260 WeakPolarHBondContact O-CG2 3.49Å; P257-F267 HydrophobicContact CG-CE1 4Å; P257-F267 HydrophobicContact CG-CZ 3.95Å
258	G	71.3	Confident	76.9	Confident	38 Å²	38	59.7 Å²	59.7	39%	0.392	32%	0.315	S	S	.	.	S	Bend	trans	-59.3	162.4	175.4	0	0	0	0	0	111.6	S256 V260	S256-G258 PolarHBondContact O-N 3.01Å; G258-V260 VanDerWaalsContact C-N 3.34Å; G258-V260 WeakPolarHBondContact O-CG2 3.1Å; G258-V260 PolarHBondContact O-N 3.49Å
259	R	64.1	Low	75.1	Confident	248 Å²	248	60.8 Å²	60.8	94%	0.936	32%	0.322	S	S	*	.	S	Bend	trans	2.8	76.6	-177.2	-73.8	-167.4	-173	-170.8	3.5	114.3
260	V	61.5	Low	73.8	Confident	35 Å²	35	60.9 Å²	60.9	21%	0.212	32%	0.323	C	S	.	.			trans	-79.7	146.6	175.8	-154.4	0	0	0	0	109.1	P257 G258 F262 F267	P257-V260 HydrophobicContact CB-CG2 3.58Å; P257-V260 HydrophobicContact CG-CG2 3.53Å; P257-V260 WeakPolarHBondContact O-CG2 3.49Å; G258-V260 VanDerWaalsContact C-N 3.34Å; G258-V260 WeakPolarHBondContact O-CG2 3.1Å; G258-V260 PolarHBondContact O-N 3.49Å; V260-F262 HydrophobicContact CB-CD2 3.98Å; V260-F262 HydrophobicContact CG1-CB 4.49Å; V260-F262 HydrophobicContact CG1-CD2 3.09Å; V260-F262 HydrophobicContact CG1-CE2 3.37Å; V260-F262 HydrophobicContact CG1-CG 4.02Å; V260-F262 HydrophobicContact CG1-CZ 4.49Å; V260-F262 PolarHBondContact O-N 3.41Å; V260-F267 HydrophobicContact CB-CE2 4.23Å; V260-F267 HydrophobicContact CB-CZ 4.29Å; V260-F267 HydrophobicContact CG2-CE2 4.22Å; V260-F267 HydrophobicContact CG2-CZ 3.84Å
261	I	60.4	Low	72.8	Confident	175 Å²	175	63.4 Å²	63.4	90%	0.897	33%	0.334	S	S	*	.	S	Bend	trans	-68.9	-10.3	178	-58.8	167.8	0	0	0	111.2
262	F	62	Low	71.7	Confident	116 Å²	116	60.1 Å²	60.1	51%	0.509	32%	0.32	S	S	.	.	S	Bend	trans	-71	149.2	-179.9	-57.1	-59.7	0	0	0	112.3	V260 F267	V260-F262 HydrophobicContact CB-CD2 3.98Å; V260-F262 HydrophobicContact CG1-CB 4.49Å; V260-F262 HydrophobicContact CG1-CD2 3.09Å; V260-F262 HydrophobicContact CG1-CE2 3.37Å; V260-F262 HydrophobicContact CG1-CG 4.02Å; V260-F262 HydrophobicContact CG1-CZ 4.49Å; V260-F262 PolarHBondContact O-N 3.41Å; F262-F267 HydrophobicContact CB-CE2 4.25Å; F262-F267 HydrophobicContact CD2-CE2 4.38Å
263	S	66.5	Low	70.6	Confident	63 Å²	63	60.6 Å²	60.6	44%	0.441	32%	0.323	S	S	.	.			trans	-59.4	135.7	173.3	177.6	0	0	0	0	109.4	S265 D266	S263-S265 WeakPolarHBondContact CB-OG 3.4Å; S263-S265 PolarHBondContact O-N 2.9Å; S263-S265 PolarHBondContact OG-OG 2.74Å; S263-D266 PolarHBondContact O-N 3.47Å; S263-D266 VanDerWaalsContact O-N 3.08Å
264	P	62.3	Low	69.9	Low	102 Å²	102	65.2 Å²	65.2	66%	0.662	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-52.5	-22.4	177.2	-27.4	34	0	0	0	114.8	D266	P264-D266 PolarHBondContact O-N 3.11Å
265	S	66.4	Low	69.8	Low	65 Å²	65	65.1 Å²	65.1	46%	0.455	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-57.5	-31.1	176.2	51.1	0	0	0	0	114.1	S263	S263-S265 WeakPolarHBondContact CB-OG 3.4Å; S263-S265 PolarHBondContact O-N 2.9Å; S263-S265 PolarHBondContact OG-OG 2.74Å
266	D	62.5	Low	70	Confident	93 Å²	93	65.3 Å²	65.3	50%	0.497	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-87	-13.6	-166.2	-54.2	-17.9	0	0	0	112.7	S263 P264	S263-D266 PolarHBondContact O-N 3.47Å; S263-D266 VanDerWaalsContact O-N 3.08Å; P264-D266 PolarHBondContact O-N 3.11Å
267	F	58.7	Low	70.8	Confident	15 Å²	15	67.6 Å²	67.6	7%	0.066	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-86.4	-10.2	177.5	-82	-84.1	0	0	0	114.3	W231 P236 P257 V260 F262 S269 F294	W231-F267 HydrophobicContact CH2-CE1 4Å; W231-F267 HydrophobicContact CZ3-CE1 4.11Å; P236-F267 HydrophobicContact CG-CD1 3.54Å; P236-F267 HydrophobicContact CG-CE1 3.61Å; P236-F267 HydrophobicContact CG-CG 4.2Å; P236-F267 HydrophobicContact CG-CZ 4.31Å; P257-F267 HydrophobicContact CG-CE1 4Å; P257-F267 HydrophobicContact CG-CZ 3.95Å; V260-F267 HydrophobicContact CB-CE2 4.23Å; V260-F267 HydrophobicContact CB-CZ 4.29Å; V260-F267 HydrophobicContact CG2-CE2 4.22Å; V260-F267 HydrophobicContact CG2-CZ 3.84Å; F262-F267 HydrophobicContact CB-CE2 4.25Å; F262-F267 HydrophobicContact CD2-CE2 4.38Å; F267-S269 PolarHBondContact O-N 2.97Å; F267-F294 HydrophobicContact CD1-CZ 4.07Å
268	L	57.7	Low	71.8	Confident	82 Å²	82	70.3 Å²	70.3	43%	0.429	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-0.5	-173.9	-74.4	163.6	0	0	0	114.7	G293 T295	L268-G293 WeakPolarHBondContact CD2-O 3.2Å; L268-T295 HydrophobicContact CD2-CG2 3.45Å; L268-T295 VanDerWaalsContact CD2-CG2 3.45Å; L268-T295 PolarHBondContact O-OG1 3.2Å; L268-T295 VanDerWaalsContact O-OG1 3.08Å
269	S	60.7	Low	73	Confident	61 Å²	61	69.1 Å²	69.1	43%	0.427	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-3.1	-164.4	68.5	0	0	0	0	117.1	F267 K271	F267-S269 PolarHBondContact O-N 2.97Å; S269-K271 PolarHBondContact O-N 2.86Å
270	I	69.3	Low	74.6	Confident	7 Å²	7	61 Å²	61	4%	0.036	34%	0.335	C	S	.	.			trans	-71.7	100.5	176.7	-51	-168.9	0	0	0	109	W231 P236 V239 L272 F294 V296	W231-I270 HydrophobicContact CH2-CD1 3.98Å; W231-I270 HydrophobicContact CZ2-CD1 4.27Å; P236-I270 HydrophobicContact CB-CD1 3.78Å; P236-I270 HydrophobicContact CB-CG1 3.58Å; V239-I270 HydrophobicContact CB-CD1 4.31Å; V239-I270 HydrophobicContact CG1-CD1 4.45Å; I270-L272 VanDerWaalsContact C-N 3.26Å; I270-L272 HydrophobicContact CG2-CD1 4.47Å; I270-L272 HydrophobicContact CG2-CG 4.02Å; I270-L272 PolarHBondContact O-N 2.89Å; I270-L272 VanDerWaalsContact O-N 3.11Å; I270-F294 HydrophobicContact CB-CD1 4.37Å; I270-F294 HydrophobicContact CB-CE1 4.09Å; I270-F294 HydrophobicContact CD1-CE1 3.7Å; I270-F294 HydrophobicContact CD1-CZ 4.33Å; I270-F294 HydrophobicContact CG1-CE1 3.86Å; I270-V296 WeakPolarHBondContact O-CG2 3.38Å
271	K	77.3	Confident	76.3	Confident	130 Å²	130	62.8 Å²	62.8	57%	0.565	34%	0.343	S	S	*	.			trans	-86.8	63.9	175.4	-66.1	-176.2	-179.8	-178.7	0	110.4	S269 V273 D274 S275	S269-K271 PolarHBondContact O-N 2.86Å; K271-V273 PolarHBondContact O-N 2.78Å; K271-D274 HydrophobicContact CB-CB 4.21Å; K271-D274 WeakPolarHBondContact O-CA 3.39Å; K271-D274 PolarHBondContact O-N 3.48Å; K271-S275 PolarHBondContact O-N 3.39Å; K271-S275 PolarHBondContact O-OG 3.34Å
272	L	77.1	Confident	78.1	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-39.5	-39.6	180	-94.9	148.9	0	0	0	114.4	L243 L252 L254 I270 D274 S275 L276 F285 V296 W298 F301	L243-L272 HydrophobicContact CD1-CD2 3.95Å; L252-L272 HydrophobicContact CD2-CD2 4.11Å; L254-L272 HydrophobicContact CD1-CD1 4.46Å; L254-L272 HydrophobicContact CD1-CD2 3.77Å; I270-L272 VanDerWaalsContact C-N 3.26Å; I270-L272 HydrophobicContact CG2-CD1 4.47Å; I270-L272 HydrophobicContact CG2-CG 4.02Å; I270-L272 PolarHBondContact O-N 2.89Å; I270-L272 VanDerWaalsContact O-N 3.11Å; L272-D274 VanDerWaalsContact C-N 3.31Å; L272-D274 PolarHBondContact O-N 2.68Å; L272-S275 WeakPolarHBondContact CA-OG 3.44Å; L272-S275 PolarHBondContact N-OG 2.94Å; L272-S275 PolarHBondContact O-N 3.12Å; L272-L276 PolarHBondContact O-N 3.1Å; L272-F285 HydrophobicContact CD2-CE2 4.35Å; L272-V296 HydrophobicContact CB-CG1 4.43Å; L272-V296 HydrophobicContact CD1-CG2 4.29Å; L272-W298 HydrophobicContact CD1-CH2 3.84Å; L272-W298 HydrophobicContact CD1-CZ3 4.23Å; L272-F301 HydrophobicContact CB-CD2 4.45Å
273	V	73	Confident	79.8	Confident	14 Å²	14	52.8 Å²	52.8	9%	0.085	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-36.3	178.4	-177.2	0	0	0	0	113.8	K271 V296 A300 F301 K304	K271-V273 PolarHBondContact O-N 2.78Å; V273-V296 HydrophobicContact CG2-CG1 4.42Å; V273-A300 HydrophobicContact CG1-CB 4.09Å; V273-A300 HydrophobicContact CG2-CB 4.28Å; V273-F301 HydrophobicContact CG2-CB 3.63Å; V273-F301 HydrophobicContact CG2-CD2 4.43Å; V273-K304 HydrophobicContact CG1-CD 3.87Å; V273-K304 VanDerWaalsContact CG1-CE 3.48Å; V273-K304 PolarHBondContact O-NZ 3.45Å
274	D	81.6	Confident	81.4	Confident	107 Å²	107	50.8 Å²	50.8	57%	0.572	28%	0.279	S	S	*	.	H	α-helix	trans	-99.4	-21.9	-176.2	-60.3	-28.9	0	0	0	111.2	K271 L272 K304	K271-D274 HydrophobicContact CB-CB 4.21Å; K271-D274 WeakPolarHBondContact O-CA 3.39Å; K271-D274 PolarHBondContact O-N 3.48Å; L272-D274 VanDerWaalsContact C-N 3.31Å; L272-D274 PolarHBondContact O-N 2.68Å; D274-K304 IonicContact OD1-NZ 3.76Å; D274-K304 PolarHBondContact OD1-NZ 3Å
275	S	89.5	Confident	83	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-72.3	-31.1	178.3	-24.1	0	0	0	0	112.8	D240 L243 S244 K271 L272 P277	D240-S275 WeakPolarHBondContact OD1-CB 3.45Å; D240-S275 PolarHBondContact OD1-OG 3.16Å; L243-S275 CarbonylContact C-O 3.19Å; L243-S275 VanDerWaalsContact O-O 3.11Å; S244-S275 WeakPolarHBondContact CA-O 2.96Å; S244-S275 PolarHBondContact N-O 2.78Å; K271-S275 PolarHBondContact O-N 3.39Å; K271-S275 PolarHBondContact O-OG 3.34Å; L272-S275 WeakPolarHBondContact CA-OG 3.44Å; L272-S275 PolarHBondContact N-OG 2.94Å; L272-S275 PolarHBondContact O-N 3.12Å; S275-P277 WeakPolarHBondContact O-CD 3.35Å
276	L	94.4	Very high	84.4	Confident	12 Å²	12	45 Å²	45	6%	0.063	24%	0.236	C	C	.	.			trans	-83.5	123.1	-177.8	-68.8	176.8	0	0	0	110.4	L243 L249 L252 L272 N278 P279 L282 F301	L243-L276 HydrophobicContact CB-CD2 4.11Å; L243-L276 HydrophobicContact CD2-CD2 4.15Å; L249-L276 HydrophobicContact CD2-CD2 3.78Å; L252-L276 HydrophobicContact CD2-CD1 4.44Å; L272-L276 PolarHBondContact O-N 3.1Å; L276-N278 VanDerWaalsContact C-N 3.34Å; L276-P279 HydrophobicContact CB-CB 4.12Å; L276-P279 HydrophobicContact CD1-CB 4.49Å; L276-P279 WeakPolarHBondContact O-CD 3.32Å; L276-L282 HydrophobicContact CD1-CD2 4.35Å; L276-F301 HydrophobicContact CD1-CE2 3.91Å
277	P	95.6	Very high	85.8	Confident	51 Å²	51	40.8 Å²	40.8	33%	0.331	21%	0.213	S	C	.	.	S	Bend	trans	-70.5	-30.5	178.2	27	-35.4	0	0	0	112.8	L243 C246 R247 S275	L243-P277 VanDerWaalsContact O-CD 3.24Å; L243-P277 WeakPolarHBondContact O-CD 3.45Å; C246-P277 WeakPolarHBondContact O-CG 3.37Å; R247-P277 HydrophobicContact CG-CB 4.43Å; R247-P277 HydrophobicContact CG-CG 4.03Å; S275-P277 WeakPolarHBondContact O-CD 3.35Å
278	N	96.8	Very high	87.2	Confident	58 Å²	58	41.2 Å²	41.2	31%	0.31	22%	0.215	S	C	.	.			trans	-134.1	62.5	-179.1	-70.7	-45	0	0	0	111.6	R247 L276 Q280 L281	R247-N278 PolarHBondContact O-ND2 2.84Å; L276-N278 VanDerWaalsContact C-N 3.34Å; N278-Q280 VanDerWaalsContact CA-OE1 3.22Å; N278-Q280 PolarHBondContact O-N 2.86Å; N278-Q280 VanDerWaalsContact O-N 3.08Å; N278-Q280 PolarHBondContact OD1-NE2 3.13Å; N278-Q280 VanDerWaalsContact OD1-NE2 3.09Å; N278-L281 HydrophobicContact CB-CD1 3.75Å; N278-L281 HydrophobicContact CB-CG 4.01Å; N278-L281 PolarHBondContact O-N 2.73Å
279	P	96.4	Very high	88.4	Confident	13 Å²	13	37.9 Å²	37.9	8%	0.084	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-59.4	-24.2	-177.4	26.8	-35	0	0	0	112.6	L276 L281 L282 K304	L276-P279 HydrophobicContact CB-CB 4.12Å; L276-P279 HydrophobicContact CD1-CB 4.49Å; L276-P279 WeakPolarHBondContact O-CD 3.32Å; P279-L281 PolarHBondContact O-N 3.35Å; P279-L281 VanDerWaalsContact O-N 3.17Å; P279-L282 VanDerWaalsContact O-CB 3.31Å; P279-L282 WeakPolarHBondContact O-CB 3.39Å; P279-L282 PolarHBondContact O-N 3.07Å; P279-L282 VanDerWaalsContact O-N 3.11Å; P279-K304 CarbonylContact C-O 3.54Å; P279-K304 HydrophobicContact CB-CB 3.93Å; P279-K304 HydrophobicContact CG-CB 3.68Å; P279-K304 HydrophobicContact CG-CD 4.11Å; P279-K304 HydrophobicContact CG-CG 4.49Å
280	Q	97	Very high	88.9	Confident	79 Å²	79	40.9 Å²	40.9	37%	0.369	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-64.7	-15.3	175.9	74.4	-76.3	0.7	0	0	114.6	N278 K304 P306 Q307	N278-Q280 VanDerWaalsContact CA-OE1 3.22Å; N278-Q280 PolarHBondContact O-N 2.86Å; N278-Q280 VanDerWaalsContact O-N 3.08Å; N278-Q280 PolarHBondContact OD1-NE2 3.13Å; N278-Q280 VanDerWaalsContact OD1-NE2 3.09Å; Q280-K304 PolarHBondContact N-O 2.68Å; Q280-P306 HydrophobicContact CB-CG 4.26Å; Q280-Q307 VanDerWaalsContact O-CB 3.27Å; Q280-Q307 WeakPolarHBondContact O-CB 3.42Å; Q280-Q307 WeakPolarHBondContact O-CG 3.45Å
281	L	97.7	Very high	88.5	Confident	71 Å²	71	42.4 Å²	42.4	37%	0.372	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-87	-12.5	176.3	-62.1	179.7	0	0	0	112.9	N278 P279 K283	N278-L281 HydrophobicContact CB-CD1 3.75Å; N278-L281 HydrophobicContact CB-CG 4.01Å; N278-L281 PolarHBondContact O-N 2.73Å; P279-L281 PolarHBondContact O-N 3.35Å; P279-L281 VanDerWaalsContact O-N 3.17Å; L281-K283 PolarHBondContact O-N 3.4Å
282	L	97.9	Very high	87.7	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	23%	0.229	C	C	.	.			trans	-71.5	121.5	-174.9	-163.7	73.6	0	0	0	110.7	L249 L252 L276 P279 F285 F301 Q307 L308	L249-L282 HydrophobicContact CG-CD1 4.49Å; L252-L282 HydrophobicContact CB-CD1 3.87Å; L276-L282 HydrophobicContact CD1-CD2 4.35Å; P279-L282 VanDerWaalsContact O-CB 3.31Å; P279-L282 WeakPolarHBondContact O-CB 3.39Å; P279-L282 PolarHBondContact O-N 3.07Å; P279-L282 VanDerWaalsContact O-N 3.11Å; L282-F285 HydrophobicContact CD2-CB 3.99Å; L282-F285 HydrophobicContact CD2-CD2 4.14Å; L282-F285 HydrophobicContact CD2-CG 4.34Å; L282-F301 HydrophobicContact CD2-CE1 4.45Å; L282-F301 HydrophobicContact CD2-CE2 4.47Å; L282-F301 HydrophobicContact CD2-CZ 3.65Å; L282-Q307 CarbonylContact O-C 3.54Å; L282-Q307 VanDerWaalsContact O-C 3.29Å; L282-L308 WeakPolarHBondContact O-CA 3.41Å; L282-L308 PolarHBondContact O-N 2.99Å
283	K	98.4	Very high	86.9	Confident	79 Å²	79	42.8 Å²	42.8	34%	0.343	24%	0.236	S	C	.	.			trans	-105.7	-33.2	-179.7	-69.5	175.5	166.1	-103.1	0	113	K250 L281 Q307 E309 E310	K250-K283 PolarHBondContact O-N 3.13Å; L281-K283 PolarHBondContact O-N 3.4Å; K283-Q307 WeakPolarHBondContact CA-O 3.31Å; K283-E309 IonicContact NZ-OE1 2.78Å; K283-E309 PolarHBondContact NZ-OE1 3.27Å; K283-E309 WeakPolarHBondContact O-CA 3.4Å; K283-E309 PolarHBondContact O-N 3.22Å; K283-E310 PolarHBondContact O-N 2.94Å
284	S	98.3	Very high	86.5	Confident	21 Å²	21	43.1 Å²	43.1	15%	0.147	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	128.7	179.9	-170.6	0	0	0	0	109.6	K250 K251 L252 E310	K250-S284 PolarHBondContact O-N 3.01Å; K250-S284 VanDerWaalsContact O-N 3.09Å; K251-S284 WeakPolarHBondContact CA-O 3.33Å; L252-S284 PolarHBondContact N-O 3.08Å; S284-E310 WeakPolarHBondContact CA-O 3.49Å; S284-E310 PolarHBondContact OG-OE2 3.21Å
285	F	96.7	Very high	85.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125	177.2	-178.2	-113.3	0	0	0	110.3	L252 L272 L282 F287 W298 F301 L308 E310 L311 S312	L252-F285 HydrophobicContact CB-CD2 4.14Å; L252-F285 HydrophobicContact CD2-CD2 4.1Å; L252-F285 HydrophobicContact CD2-CE2 3.89Å; L252-F285 HydrophobicContact CG-CD2 4.15Å; L252-F285 HydrophobicContact CG-CE2 4.14Å; L252-F285 WeakPolarHBondContact O-CA 3.11Å; L272-F285 HydrophobicContact CD2-CE2 4.35Å; L282-F285 HydrophobicContact CD2-CB 3.99Å; L282-F285 HydrophobicContact CD2-CD2 4.14Å; L282-F285 HydrophobicContact CD2-CG 4.34Å; F285-F287 HydrophobicContact CE1-CB 3.62Å; F285-F287 HydrophobicContact CE1-CG 4.43Å; F285-F287 HydrophobicContact CZ-CB 3.66Å; F285-F287 HydrophobicContact CZ-CD2 4.31Å; F285-F287 HydrophobicContact CZ-CG 4.2Å; F285-W298 HydrophobicContact CE1-CE3 4.39Å; F285-W298 AromaticContact CE1-CH2 3.95Å; F285-W298 HydrophobicContact CE1-CH2 3.95Å; F285-W298 AromaticContact CE1-CZ3 3.42Å; F285-W298 HydrophobicContact CE1-CZ3 3.42Å; F285-W298 VanDerWaalsContact CE1-CZ3 3.42Å; F285-W298 AromaticContact CZ-CH2 3.85Å; F285-W298 HydrophobicContact CZ-CH2 3.85Å; F285-W298 AromaticContact CZ-CZ3 3.58Å; F285-W298 HydrophobicContact CZ-CZ3 3.58Å; F285-F301 AromaticContact CD1-CE1 3.84Å; F285-F301 HydrophobicContact CD1-CE1 3.84Å; F285-F301 HydrophobicContact CD1-CZ 4.35Å; F285-F301 HydrophobicContact CD2-CE1 4.33Å; F285-F301 HydrophobicContact CD2-CZ 4.02Å; F285-F301 HydrophobicContact CE1-CE1 4.02Å; F285-F301 HydrophobicContact CE1-CZ 4.47Å; F285-F301 HydrophobicContact CE2-CE1 4.48Å; F285-F301 HydrophobicContact CE2-CZ 4.14Å; F285-F301 HydrophobicContact CG-CE1 4.01Å; F285-F301 HydrophobicContact CG-CZ 4.13Å; F285-F301 HydrophobicContact CZ-CE1 4.33Å; F285-F301 HydrophobicContact CZ-CZ 4.35Å; F285-L308 HydrophobicContact CB-CD1 3.81Å; F285-E310 PolarHBondContact N-O 3.41Å; F285-L311 HydrophobicContact CB-CD1 4.23Å; F285-L311 HydrophobicContact CD1-CD1 3.64Å; F285-L311 HydrophobicContact CG-CD1 4.43Å; F285-L311 CarbonylContact O-C 3.59Å; F285-L311 WeakPolarHBondContact O-CA 3.47Å; F285-S312 PolarHBondContact O-N 3.31Å
286	E	95.2	Very high	84.7	Confident	46 Å²	46	43.5 Å²	43.5	22%	0.215	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127	176	179.3	154.2	-131.2	0	0	110	L252 N253 L254 H288 S312	L252-E286 PolarHBondContact O-N 3.01Å; N253-E286 CarbonylContact C-O 3.19Å; N253-E286 WeakPolarHBondContact CA-O 3.31Å; N253-E286 HydrophobicContact CB-CB 4.06Å; N253-E286 PolarHBondContact ND2-OE2 3.31Å; L254-E286 PolarHBondContact N-O 2.95Å; E286-H288 WeakPolarHBondContact CG-NE2 3.21Å; E286-H288 IonicContact OE1-CE1 3.21Å; E286-H288 PolarHBondContact OE1-CE1 3.39Å; E286-H288 VanDerWaalsContact OE1-CE1 3.28Å; E286-H288 IonicContact OE1-NE2 3.02Å; E286-H288 PolarHBondContact OE1-NE2 2.69Å; E286-H288 IonicContact OE2-NE2 3.96Å; E286-S312 CarbonylContact C-O 3.46Å; E286-S312 VanDerWaalsContact CA-O 3.31Å; E286-S312 WeakPolarHBondContact CA-O 3.47Å; E286-S312 WeakPolarHBondContact OE1-CB 3.47Å; E286-S312 PolarHBondContact OE1-OG 2.98Å
287	F	92.4	Very high	84.3	Confident	5 Å²	5	46.1 Å²	46.1	2%	0.022	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	112	-178.3	-174.3	-110.4	0	0	0	111.2	L254 F285 D289 F294 W298 S312 I313 D314	L254-F287 HydrophobicContact CB-CD2 4Å; L254-F287 CarbonylContact O-C 3.06Å; L254-F287 VanDerWaalsContact O-CA 3.31Å; L254-F287 WeakPolarHBondContact O-CA 3.34Å; F285-F287 HydrophobicContact CE1-CB 3.62Å; F285-F287 HydrophobicContact CE1-CG 4.43Å; F285-F287 HydrophobicContact CZ-CB 3.66Å; F285-F287 HydrophobicContact CZ-CD2 4.31Å; F285-F287 HydrophobicContact CZ-CG 4.2Å; F287-D289 HydrophobicContact CD1-CB 3.92Å; F287-D289 HydrophobicContact CE1-CB 3.17Å; F287-D289 HydrophobicContact CE2-CB 4.4Å; F287-D289 HydrophobicContact CZ-CB 3.48Å; F287-D289 VanDerWaalsContact CZ-CB 3.48Å; F287-F294 AromaticContact CZ-CD2 3.75Å; F287-F294 HydrophobicContact CZ-CD2 3.75Å; F287-F294 AromaticContact CZ-CE2 3.96Å; F287-F294 HydrophobicContact CZ-CE2 3.96Å; F287-F294 HydrophobicContact CZ-CG 4.07Å; F287-F294 HydrophobicContact CZ-CZ 4.49Å; F287-W298 HydrophobicContact CB-CH2 4.33Å; F287-W298 AromaticContact CD1-CH2 3.6Å; F287-W298 HydrophobicContact CD1-CH2 3.6Å; F287-W298 AromaticContact CD1-CZ2 3.57Å; F287-W298 HydrophobicContact CD1-CZ2 3.57Å; F287-W298 HydrophobicContact CD2-CH2 4.06Å; F287-W298 AromaticContact CE1-CH2 3.77Å; F287-W298 HydrophobicContact CE1-CH2 3.77Å; F287-W298 AromaticContact CE1-CZ2 3.37Å; F287-W298 HydrophobicContact CE1-CZ2 3.37Å; F287-W298 HydrophobicContact CE2-CH2 4.25Å; F287-W298 HydrophobicContact CE2-CZ2 4.47Å; F287-W298 AromaticContact CG-CH2 3.73Å; F287-W298 HydrophobicContact CG-CH2 3.73Å; F287-W298 HydrophobicContact CG-CZ2 4.18Å; F287-W298 HydrophobicContact CZ-CH2 4.09Å; F287-W298 AromaticContact CZ-CZ2 3.86Å; F287-W298 HydrophobicContact CZ-CZ2 3.86Å; F287-S312 PolarHBondContact N-O 2.99Å; F287-I313 WeakPolarHBondContact O-CA 3.01Å; F287-D314 PolarHBondContact O-N 2.95Å; F287-D314 VanDerWaalsContact O-N 3.08Å
288	H	88.7	Confident	84	Confident	23 Å²	23	44.1 Å²	44.1	11%	0.106	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	106.1	174.8	-54.8	-82.2	0	0	0	109.4	L254 C255 S256 E286 D314	L254-H288 PolarHBondContact O-N 3.24Å; C255-H288 CarbonylContact C-O 3.49Å; C255-H288 WeakPolarHBondContact CA-O 3.31Å; C255-H288 HydrophobicContact CB-CB 3.78Å; S256-H288 PolarHBondContact N-O 3.08Å; S256-H288 PolarHBondContact OG-O 3.11Å; E286-H288 WeakPolarHBondContact CG-NE2 3.21Å; E286-H288 IonicContact OE1-CE1 3.21Å; E286-H288 PolarHBondContact OE1-CE1 3.39Å; E286-H288 VanDerWaalsContact OE1-CE1 3.28Å; E286-H288 IonicContact OE1-NE2 3.02Å; E286-H288 PolarHBondContact OE1-NE2 2.69Å; E286-H288 IonicContact OE2-NE2 3.96Å; H288-D314 IonicContact CE1-OD2 2.88Å; H288-D314 PolarHBondContact CE1-OD2 3.06Å; H288-D314 IonicContact CG-OD2 3.84Å; H288-D314 IonicContact ND1-OD1 2.76Å; H288-D314 IonicContact ND1-OD2 2.75Å; H288-D314 PolarHBondContact ND1-OD2 3.14Å
289	D	82.9	Confident	83.9	Confident	13 Å²	13	42.7 Å²	42.7	7%	0.07	24%	0.242	C	C	.	.			trans	-116.2	116.3	178.9	175.4	35.7	0	0	0	111.7	S256 F287 C291 F294	S256-D289 WeakPolarHBondContact OG-CA 3.31Å; F287-D289 HydrophobicContact CD1-CB 3.92Å; F287-D289 HydrophobicContact CE1-CB 3.17Å; F287-D289 HydrophobicContact CE2-CB 4.4Å; F287-D289 HydrophobicContact CZ-CB 3.48Å; F287-D289 VanDerWaalsContact CZ-CB 3.48Å; D289-C291 WeakPolarHBondContact OD1-CA 3.3Å; D289-C291 PolarHBondContact OD1-N 2.63Å; D289-F294 HydrophobicContact CB-CD2 4.37Å; D289-F294 WeakPolarHBondContact OD1-CE2 3.48Å; D289-F294 WeakPolarHBondContact OD2-CD2 3.33Å
290	F	70.9	Confident	83.7	Confident	123 Å²	123	43.6 Å²	43.6	54%	0.539	25%	0.251	S	S	.	.			trans	-94.5	-8.2	175.3	-61.9	-73.3	0	0	0	111.9	S256	S256-F290 PolarHBondContact OG-N 3.15Å
291	C	60.9	Low	83.5	Confident	39 Å²	39	39.9 Å²	39.9	26%	0.264	23%	0.234	S	C	.	.	S	Bend	trans	-122.2	112.7	-172.6	-66.3	0	0	0	0	110.2	D289 G293	D289-C291 WeakPolarHBondContact OD1-CA 3.3Å; D289-C291 PolarHBondContact OD1-N 2.63Å; C291-G293 PolarHBondContact O-N 3.22Å
292	S	60.8	Low	83.4	Confident	125 Å²	125	36.5 Å²	36.5	87%	0.874	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	17.6	-176.2	60.1	0	0	0	0	116.9
293	G	60.4	Low	83.4	Confident	15 Å²	15	42 Å²	42	16%	0.155	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-0.8	-171.5	0	0	0	0	0	115.9	L268 C291 T295	L268-G293 WeakPolarHBondContact CD2-O 3.2Å; C291-G293 PolarHBondContact O-N 3.22Å; G293-T295 PolarHBondContact O-N 3.29Å
294	F	63.6	Low	83.3	Confident	20 Å²	20	42.2 Å²	42.2	9%	0.088	24%	0.241	C	C	.	.			trans	-81.8	106.5	177.4	-71.5	-78.8	0	0	0	111.8	F267 I270 F287 D289 V296	F267-F294 HydrophobicContact CD1-CZ 4.07Å; I270-F294 HydrophobicContact CB-CD1 4.37Å; I270-F294 HydrophobicContact CB-CE1 4.09Å; I270-F294 HydrophobicContact CD1-CE1 3.7Å; I270-F294 HydrophobicContact CD1-CZ 4.33Å; I270-F294 HydrophobicContact CG1-CE1 3.86Å; F287-F294 AromaticContact CZ-CD2 3.75Å; F287-F294 HydrophobicContact CZ-CD2 3.75Å; F287-F294 AromaticContact CZ-CE2 3.96Å; F287-F294 HydrophobicContact CZ-CE2 3.96Å; F287-F294 HydrophobicContact CZ-CG 4.07Å; F287-F294 HydrophobicContact CZ-CZ 4.49Å; D289-F294 HydrophobicContact CB-CD2 4.37Å; D289-F294 WeakPolarHBondContact OD1-CE2 3.48Å; D289-F294 WeakPolarHBondContact OD2-CD2 3.33Å; F294-V296 HydrophobicContact CB-CG2 4.14Å; F294-V296 HydrophobicContact CD1-CG2 4.48Å; F294-V296 PolarHBondContact O-N 3.35Å; F294-V296 VanDerWaalsContact O-N 3.14Å
295	T	64.5	Low	83.2	Confident	102 Å²	102	41.2 Å²	41.2	63%	0.626	23%	0.234	S	C	*	.			trans	-84.6	67.7	164.9	48.1	0	0	0	0	110.1	L268 G293	L268-T295 HydrophobicContact CD2-CG2 3.45Å; L268-T295 VanDerWaalsContact CD2-CG2 3.45Å; L268-T295 PolarHBondContact O-OG1 3.2Å; L268-T295 VanDerWaalsContact O-OG1 3.08Å; G293-T295 PolarHBondContact O-N 3.29Å
296	V	69.1	Low	83.3	Confident	17 Å²	17	43.5 Å²	43.5	10%	0.103	25%	0.249	C	C	.	.			trans	-94.6	129.3	172.8	179.5	0	0	0	0	108.3	I270 L272 V273 F294 W298	I270-V296 WeakPolarHBondContact O-CG2 3.38Å; L272-V296 HydrophobicContact CB-CG1 4.43Å; L272-V296 HydrophobicContact CD1-CG2 4.29Å; V273-V296 HydrophobicContact CG2-CG1 4.42Å; F294-V296 HydrophobicContact CB-CG2 4.14Å; F294-V296 HydrophobicContact CD1-CG2 4.48Å; F294-V296 PolarHBondContact O-N 3.35Å; F294-V296 VanDerWaalsContact O-N 3.14Å; V296-W298 HydrophobicContact CB-CD2 4.13Å; V296-W298 HydrophobicContact CB-CG 4.38Å; V296-W298 HydrophobicContact CB-CZ2 4.13Å; V296-W298 HydrophobicContact CG1-CD2 3.83Å; V296-W298 HydrophobicContact CG1-CE3 4.03Å; V296-W298 HydrophobicContact CG1-CG 4.2Å; V296-W298 HydrophobicContact CG1-CZ2 4.33Å; V296-W298 HydrophobicContact CG1-CZ3 4.35Å; V296-W298 HydrophobicContact CG2-CZ2 4.32Å; V296-W298 PolarHBondContact O-N 3.24Å
297	S	85.7	Confident	83.4	Confident	67 Å²	67	45.3 Å²	45.3	47%	0.469	26%	0.257	S	S	.	.			trans	-73.7	80.5	164	-177.1	0	0	0	0	108.7	S299 A300 F301	S297-S299 PolarHBondContact O-N 2.76Å; S297-S299 PolarHBondContact OG-OG 3.3Å; S297-A300 WeakPolarHBondContact O-CB 3.44Å; S297-A300 PolarHBondContact O-N 2.67Å; S297-A300 WeakPolarHBondContact OG-CB 3.45Å; S297-F301 PolarHBondContact O-N 3.14Å; S297-F301 VanDerWaalsContact O-N 3.1Å
298	W	90.4	Very high	83.7	Confident	8 Å²	8	45.1 Å²	45.1	3%	0.03	26%	0.256	C	S	.	.	H	α-helix	trans	-57.1	-33.3	-179.8	-69.9	108.7	0	0	0	112.3	L272 F285 F287 V296 A300 F301 Y302 A318 C323	L272-W298 HydrophobicContact CD1-CH2 3.84Å; L272-W298 HydrophobicContact CD1-CZ3 4.23Å; F285-W298 HydrophobicContact CE1-CE3 4.39Å; F285-W298 AromaticContact CE1-CH2 3.95Å; F285-W298 HydrophobicContact CE1-CH2 3.95Å; F285-W298 AromaticContact CE1-CZ3 3.42Å; F285-W298 HydrophobicContact CE1-CZ3 3.42Å; F285-W298 VanDerWaalsContact CE1-CZ3 3.42Å; F285-W298 AromaticContact CZ-CH2 3.85Å; F285-W298 HydrophobicContact CZ-CH2 3.85Å; F285-W298 AromaticContact CZ-CZ3 3.58Å; F285-W298 HydrophobicContact CZ-CZ3 3.58Å; F287-W298 HydrophobicContact CB-CH2 4.33Å; F287-W298 AromaticContact CD1-CH2 3.6Å; F287-W298 HydrophobicContact CD1-CH2 3.6Å; F287-W298 AromaticContact CD1-CZ2 3.57Å; F287-W298 HydrophobicContact CD1-CZ2 3.57Å; F287-W298 HydrophobicContact CD2-CH2 4.06Å; F287-W298 AromaticContact CE1-CH2 3.77Å; F287-W298 HydrophobicContact CE1-CH2 3.77Å; F287-W298 AromaticContact CE1-CZ2 3.37Å; F287-W298 HydrophobicContact CE1-CZ2 3.37Å; F287-W298 HydrophobicContact CE2-CH2 4.25Å; F287-W298 HydrophobicContact CE2-CZ2 4.47Å; F287-W298 AromaticContact CG-CH2 3.73Å; F287-W298 HydrophobicContact CG-CH2 3.73Å; F287-W298 HydrophobicContact CG-CZ2 4.18Å; F287-W298 HydrophobicContact CZ-CH2 4.09Å; F287-W298 AromaticContact CZ-CZ2 3.86Å; F287-W298 HydrophobicContact CZ-CZ2 3.86Å; V296-W298 HydrophobicContact CB-CD2 4.13Å; V296-W298 HydrophobicContact CB-CG 4.38Å; V296-W298 HydrophobicContact CB-CZ2 4.13Å; V296-W298 HydrophobicContact CG1-CD2 3.83Å; V296-W298 HydrophobicContact CG1-CE3 4.03Å; V296-W298 HydrophobicContact CG1-CG 4.2Å; V296-W298 HydrophobicContact CG1-CZ2 4.33Å; V296-W298 HydrophobicContact CG1-CZ3 4.35Å; V296-W298 HydrophobicContact CG2-CZ2 4.32Å; V296-W298 PolarHBondContact O-N 3.24Å; W298-A300 PolarHBondContact O-N 3.18Å; W298-F301 HydrophobicContact CE3-CD1 4.22Å; W298-F301 HydrophobicContact CZ3-CD1 4.39Å; W298-F301 WeakPolarHBondContact O-CB 3.47Å; W298-F301 PolarHBondContact O-N 2.81Å; W298-F301 VanDerWaalsContact O-N 3.16Å; W298-Y302 HydrophobicContact CB-CD2 4.5Å; W298-Y302 HydrophobicContact CB-CE2 3.81Å; W298-Y302 WeakPolarHBondContact O-CD2 3.49Å; W298-Y302 WeakPolarHBondContact O-CE2 3.48Å; W298-Y302 PolarHBondContact O-N 3.01Å; W298-A318 VanDerWaalsContact CD1-CA 3.49Å; W298-A318 HydrophobicContact CD2-CB 3.97Å; W298-A318 HydrophobicContact CG-CB 4.01Å; W298-A318 HydrophobicContact CZ2-CB 4.21Å; W298-C323 HydrophobicContact CB-CB 4.39Å; W298-C323 VanDerWaalsContact CB-SG 3.5Å
299	S	93.1	Very high	84.1	Confident	28 Å²	28	47 Å²	47	20%	0.196	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-41.1	173.3	59	0	0	0	0	112.6	S297 F301 K303 C323 A326	S297-S299 PolarHBondContact O-N 2.76Å; S297-S299 PolarHBondContact OG-OG 3.3Å; S299-F301 VanDerWaalsContact C-N 3.33Å; S299-K303 VanDerWaalsContact O-CG 3.32Å; S299-K303 WeakPolarHBondContact O-CG 3.46Å; S299-K303 PolarHBondContact O-N 3.06Å; S299-C323 PolarHBondContact N-SG 2.88Å; S299-A326 WeakPolarHBondContact O-CB 3.1Å
300	A	93.6	Very high	84.9	Confident	33 Å²	33	49.2 Å²	49.2	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-67.9	-33.7	174.3	0	0	0	0	0	112.1	V273 S297 W298	V273-A300 HydrophobicContact CG1-CB 4.09Å; V273-A300 HydrophobicContact CG2-CB 4.28Å; S297-A300 WeakPolarHBondContact O-CB 3.44Å; S297-A300 PolarHBondContact O-N 2.67Å; S297-A300 WeakPolarHBondContact OG-CB 3.45Å; W298-A300 PolarHBondContact O-N 3.18Å
301	F	93.1	Very high	86.1	Confident	1 Å²	1	43.6 Å²	43.6	0%	0.004	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-55.4	174.1	-179.9	-107.6	0	0	0	111.3	L272 V273 L276 L282 F285 S297 W298 S299 K303 K304 C305	L272-F301 HydrophobicContact CB-CD2 4.45Å; V273-F301 HydrophobicContact CG2-CB 3.63Å; V273-F301 HydrophobicContact CG2-CD2 4.43Å; L276-F301 HydrophobicContact CD1-CE2 3.91Å; L282-F301 HydrophobicContact CD2-CE1 4.45Å; L282-F301 HydrophobicContact CD2-CE2 4.47Å; L282-F301 HydrophobicContact CD2-CZ 3.65Å; F285-F301 AromaticContact CD1-CE1 3.84Å; F285-F301 HydrophobicContact CD1-CE1 3.84Å; F285-F301 HydrophobicContact CD1-CZ 4.35Å; F285-F301 HydrophobicContact CD2-CE1 4.33Å; F285-F301 HydrophobicContact CD2-CZ 4.02Å; F285-F301 HydrophobicContact CE1-CE1 4.02Å; F285-F301 HydrophobicContact CE1-CZ 4.47Å; F285-F301 HydrophobicContact CE2-CE1 4.48Å; F285-F301 HydrophobicContact CE2-CZ 4.14Å; F285-F301 HydrophobicContact CG-CE1 4.01Å; F285-F301 HydrophobicContact CG-CZ 4.13Å; F285-F301 HydrophobicContact CZ-CE1 4.33Å; F285-F301 HydrophobicContact CZ-CZ 4.35Å; S297-F301 PolarHBondContact O-N 3.14Å; S297-F301 VanDerWaalsContact O-N 3.1Å; W298-F301 HydrophobicContact CE3-CD1 4.22Å; W298-F301 HydrophobicContact CZ3-CD1 4.39Å; W298-F301 WeakPolarHBondContact O-CB 3.47Å; W298-F301 PolarHBondContact O-N 2.81Å; W298-F301 VanDerWaalsContact O-N 3.16Å; S299-F301 VanDerWaalsContact C-N 3.33Å; F301-K303 VanDerWaalsContact C-N 3.27Å; F301-K303 PolarHBondContact O-N 2.83Å; F301-K304 PolarHBondContact O-N 2.91Å; F301-C305 PolarHBondContact O-N 3.42Å; F301-C305 PolarHBondContact O-SG 3.17Å; F301-C305 VanDerWaalsContact O-SG 3.41Å
302	Y	95.3	Very high	87.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-34.3	-176.7	-58.5	-43.5	0	0	0	112.8	W298 K304 C305 L308 L311 I313 C323 L327	W298-Y302 HydrophobicContact CB-CD2 4.5Å; W298-Y302 HydrophobicContact CB-CE2 3.81Å; W298-Y302 WeakPolarHBondContact O-CD2 3.49Å; W298-Y302 WeakPolarHBondContact O-CE2 3.48Å; W298-Y302 PolarHBondContact O-N 3.01Å; Y302-K304 PolarHBondContact O-N 3.08Å; Y302-C305 PolarHBondContact O-N 3.24Å; Y302-C305 VanDerWaalsContact O-N 3.07Å; Y302-L308 HydrophobicContact CD1-CD2 4.41Å; Y302-L311 HydrophobicContact CE1-CD1 4.12Å; Y302-L311 HydrophobicContact CE1-CD2 4.28Å; Y302-I313 WeakPolarHBondContact OH-CD1 3.44Å; Y302-C323 HydrophobicContact CD2-CB 4.27Å; Y302-C323 HydrophobicContact CE2-CB 3.98Å; Y302-L327 HydrophobicContact CD1-CD2 3.44Å; Y302-L327 VanDerWaalsContact CD1-CD2 3.44Å; Y302-L327 HydrophobicContact CD1-CG 4.35Å; Y302-L327 HydrophobicContact CD2-CD1 4.32Å; Y302-L327 HydrophobicContact CD2-CD2 3.71Å; Y302-L327 HydrophobicContact CD2-CG 3.69Å; Y302-L327 HydrophobicContact CE1-CD2 3.95Å; Y302-L327 HydrophobicContact CE2-CD1 4.28Å; Y302-L327 HydrophobicContact CE2-CD2 4.18Å; Y302-L327 HydrophobicContact CE2-CG 4.14Å; Y302-L327 HydrophobicContact CG-CD2 3.35Å; Y302-L327 HydrophobicContact CG-CG 3.84Å
303	K	96.3	Very high	89.3	Confident	116 Å²	116	36.4 Å²	36.4	50%	0.504	20%	0.2	S	C	.	.	H	α-helix	trans	-57.6	-30.5	172.1	-77.7	174.7	-179.6	-174.2	0	113.5	S299 F301 A326 N330	S299-K303 VanDerWaalsContact O-CG 3.32Å; S299-K303 WeakPolarHBondContact O-CG 3.46Å; S299-K303 PolarHBondContact O-N 3.06Å; F301-K303 VanDerWaalsContact C-N 3.27Å; F301-K303 PolarHBondContact O-N 2.83Å; K303-A326 HydrophobicContact CG-CB 4.18Å; K303-N330 WeakPolarHBondContact CG-ND2 3.03Å
304	K	96.6	Very high	90.6	Very high	85 Å²	85	36.8 Å²	36.8	37%	0.37	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.1	178.9	-64.9	-169.8	-171.7	177.5	0	113.9	V273 D274 P279 Q280 F301 Y302 P306	V273-K304 HydrophobicContact CG1-CD 3.87Å; V273-K304 VanDerWaalsContact CG1-CE 3.48Å; V273-K304 PolarHBondContact O-NZ 3.45Å; D274-K304 IonicContact OD1-NZ 3.76Å; D274-K304 PolarHBondContact OD1-NZ 3Å; P279-K304 CarbonylContact C-O 3.54Å; P279-K304 HydrophobicContact CB-CB 3.93Å; P279-K304 HydrophobicContact CG-CB 3.68Å; P279-K304 HydrophobicContact CG-CD 4.11Å; P279-K304 HydrophobicContact CG-CG 4.49Å; Q280-K304 PolarHBondContact N-O 2.68Å; F301-K304 PolarHBondContact O-N 2.91Å; Y302-K304 PolarHBondContact O-N 3.08Å; K304-P306 WeakPolarHBondContact O-CD 3.49Å
305	C	97.2	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.			trans	-115.7	60.1	-174.8	-61.1	0	0	0	0	112.7	F301 Y302 Q307 L308 C331	F301-C305 PolarHBondContact O-N 3.42Å; F301-C305 PolarHBondContact O-SG 3.17Å; F301-C305 VanDerWaalsContact O-SG 3.41Å; Y302-C305 PolarHBondContact O-N 3.24Å; Y302-C305 VanDerWaalsContact O-N 3.07Å; C305-Q307 PolarHBondContact O-N 2.96Å; C305-L308 HydrophobicContact CB-CB 4.37Å; C305-L308 WeakPolarHBondContact O-CB 3.41Å; C305-L308 PolarHBondContact O-N 3.28Å; C305-C331 PolarHBondContact O-SG 3.46Å; C305-C331 VanDerWaalsContact O-SG 3.35Å
306	P	97.7	Very high	92.4	Very high	48 Å²	48	34.3 Å²	34.3	31%	0.312	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-18.8	-175.9	27.8	-37.3	0	0	0	114.8	Q280 K304 L308 N330	Q280-P306 HydrophobicContact CB-CG 4.26Å; K304-P306 WeakPolarHBondContact O-CD 3.49Å; P306-L308 VanDerWaalsContact C-N 3.32Å; P306-N330 VanDerWaalsContact CA-O 3.3Å; P306-N330 WeakPolarHBondContact CA-O 3.04Å
307	Q	98	Very high	93	Very high	84 Å²	84	36.4 Å²	36.4	39%	0.393	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	7.5	179	-61.6	-63.5	-51.8	0	0	113.4	Q280 L282 K283 C305 E309	Q280-Q307 VanDerWaalsContact O-CB 3.27Å; Q280-Q307 WeakPolarHBondContact O-CB 3.42Å; Q280-Q307 WeakPolarHBondContact O-CG 3.45Å; L282-Q307 CarbonylContact O-C 3.54Å; L282-Q307 VanDerWaalsContact O-C 3.29Å; K283-Q307 WeakPolarHBondContact CA-O 3.31Å; C305-Q307 PolarHBondContact O-N 2.96Å; Q307-E309 PolarHBondContact O-N 2.81Å
308	L	98.3	Very high	92.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.181	C	C	.	.			trans	-66.1	119.3	-178.4	-166	71.4	0	0	0	110.5	L282 F285 Y302 C305 P306 E310 L311 L327 C331 L333 L334	L282-L308 WeakPolarHBondContact O-CA 3.41Å; L282-L308 PolarHBondContact O-N 2.99Å; F285-L308 HydrophobicContact CB-CD1 3.81Å; Y302-L308 HydrophobicContact CD1-CD2 4.41Å; C305-L308 HydrophobicContact CB-CB 4.37Å; C305-L308 WeakPolarHBondContact O-CB 3.41Å; C305-L308 PolarHBondContact O-N 3.28Å; P306-L308 VanDerWaalsContact C-N 3.32Å; L308-E310 WeakPolarHBondContact CD1-O 3.09Å; L308-L311 HydrophobicContact CD2-CB 4.32Å; L308-L311 HydrophobicContact CD2-CD1 4.25Å; L308-L327 HydrophobicContact CD2-CD2 4.3Å; L308-C331 HydrophobicContact CB-CB 4.34Å; L308-L333 CarbonylContact O-C 3.44Å; L308-L334 HydrophobicContact CD2-CD1 4.38Å; L308-L334 HydrophobicContact CG-CD1 4.32Å; L308-L334 VanDerWaalsContact O-CA 3.24Å; L308-L334 WeakPolarHBondContact O-CA 3.47Å; L308-L334 PolarHBondContact O-N 2.77Å
309	E	98.5	Very high	92.9	Very high	63 Å²	63	33 Å²	33	29%	0.294	18%	0.18	S	C	.	.			trans	-104.3	-30.8	-179.8	-67.6	169.4	-155	0	0	111.5	K283 Q307 L333 S335 K336	K283-E309 IonicContact NZ-OE1 2.78Å; K283-E309 PolarHBondContact NZ-OE1 3.27Å; K283-E309 WeakPolarHBondContact O-CA 3.4Å; K283-E309 PolarHBondContact O-N 3.22Å; Q307-E309 PolarHBondContact O-N 2.81Å; E309-L333 HydrophobicContact CG-CB 4.08Å; E309-S335 PolarHBondContact O-N 2.83Å; E309-S335 PolarHBondContact O-OG 2.91Å; E309-K336 PolarHBondContact O-N 2.88Å; E309-K336 VanDerWaalsContact O-N 3.11Å
310	E	98.4	Very high	92.8	Very high	60 Å²	60	34.6 Å²	34.6	28%	0.28	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133.8	-175.8	-52.5	-177.3	157.1	0	0	111.2	K283 S284 F285 L308 K336	K283-E310 PolarHBondContact O-N 2.94Å; S284-E310 WeakPolarHBondContact CA-O 3.49Å; S284-E310 PolarHBondContact OG-OE2 3.21Å; F285-E310 PolarHBondContact N-O 3.41Å; L308-E310 WeakPolarHBondContact CD1-O 3.09Å; E310-K336 WeakPolarHBondContact CA-O 3.32Å; E310-K336 HydrophobicContact CB-CB 4.37Å; E310-K336 HydrophobicContact CG-CB 4.16Å; E310-K336 HydrophobicContact CG-CD 3.97Å; E310-K336 HydrophobicContact CG-CG 4.23Å; E310-K336 WeakPolarHBondContact OE1-CD 3.42Å; E310-K336 WeakPolarHBondContact OE1-CE 3.29Å; E310-K336 IonicContact OE1-NZ 2.8Å; E310-K336 PolarHBondContact OE1-NZ 2.86Å
311	L	97.4	Very high	92.8	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.1	178.6	-178.4	58.7	0	0	0	110.2	F285 Y302 L308 I313 L327 L334 K336 V337 K338	F285-L311 HydrophobicContact CB-CD1 4.23Å; F285-L311 HydrophobicContact CD1-CD1 3.64Å; F285-L311 HydrophobicContact CG-CD1 4.43Å; F285-L311 CarbonylContact O-C 3.59Å; F285-L311 WeakPolarHBondContact O-CA 3.47Å; Y302-L311 HydrophobicContact CE1-CD1 4.12Å; Y302-L311 HydrophobicContact CE1-CD2 4.28Å; L308-L311 HydrophobicContact CD2-CB 4.32Å; L308-L311 HydrophobicContact CD2-CD1 4.25Å; L311-I313 HydrophobicContact CD1-CD1 3.73Å; L311-I313 HydrophobicContact CD1-CG1 3.75Å; L311-I313 HydrophobicContact CD2-CD1 3.82Å; L311-I313 HydrophobicContact CD2-CG1 4.5Å; L311-I313 HydrophobicContact CG-CD1 3.81Å; L311-I313 HydrophobicContact CG-CG1 3.95Å; L311-L327 HydrophobicContact CD2-CD1 3.6Å; L311-L327 HydrophobicContact CD2-CD2 3.77Å; L311-L327 HydrophobicContact CD2-CG 4.37Å; L311-L334 HydrophobicContact CB-CD1 3.76Å; L311-L334 HydrophobicContact CD2-CD2 4.41Å; L311-K336 PolarHBondContact N-O 2.96Å; L311-V337 CarbonylContact O-C 3.59Å; L311-V337 VanDerWaalsContact O-CA 3.29Å; L311-V337 WeakPolarHBondContact O-CA 3.24Å; L311-K338 PolarHBondContact O-N 2.93Å
312	S	95.6	Very high	92.8	Very high	11 Å²	11	39.8 Å²	39.8	8%	0.077	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	118.4	174.9	177.6	0	0	0	0	109.3	F285 E286 F287 K338	F285-S312 PolarHBondContact O-N 3.31Å; E286-S312 CarbonylContact C-O 3.46Å; E286-S312 VanDerWaalsContact CA-O 3.31Å; E286-S312 WeakPolarHBondContact CA-O 3.47Å; E286-S312 WeakPolarHBondContact OE1-CB 3.47Å; E286-S312 PolarHBondContact OE1-OG 2.98Å; F287-S312 PolarHBondContact N-O 2.99Å; S312-K338 WeakPolarHBondContact CA-O 3.47Å; S312-K338 WeakPolarHBondContact OG-CD 3.49Å
313	I	92.6	Very high	92.8	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	116.2	-176.4	-61.5	173.9	0	0	0	109.6	F287 Y302 L311 S315 A318 L319 K338 V339 H340	F287-I313 WeakPolarHBondContact O-CA 3.01Å; Y302-I313 WeakPolarHBondContact OH-CD1 3.44Å; L311-I313 HydrophobicContact CD1-CD1 3.73Å; L311-I313 HydrophobicContact CD1-CG1 3.75Å; L311-I313 HydrophobicContact CD2-CD1 3.82Å; L311-I313 HydrophobicContact CD2-CG1 4.5Å; L311-I313 HydrophobicContact CG-CD1 3.81Å; L311-I313 HydrophobicContact CG-CG1 3.95Å; I313-S315 VanDerWaalsContact CG2-O 3.3Å; I313-S315 WeakPolarHBondContact CG2-O 3.3Å; I313-A318 HydrophobicContact CD1-CB 4.37Å; I313-A318 HydrophobicContact CG2-CB 3.63Å; I313-L319 HydrophobicContact CD1-CD2 3.97Å; I313-L319 HydrophobicContact CD1-CG 4.22Å; I313-L319 HydrophobicContact CG2-CD1 4.45Å; I313-L319 HydrophobicContact CG2-CG 4.41Å; I313-K338 PolarHBondContact N-O 3.11Å; I313-V339 WeakPolarHBondContact O-CA 3.37Å; I313-H340 PolarHBondContact O-N 2.99Å; I313-H340 VanDerWaalsContact O-N 3.14Å
314	D	87.5	Confident	92.8	Very high	23 Å²	23	34.5 Å²	34.5	12%	0.123	19%	0.193	C	C	.	.			trans	-91.3	-7.6	176	-75.6	2.4	0	0	0	113.4	F287 H288 H340	F287-D314 PolarHBondContact O-N 2.95Å; F287-D314 VanDerWaalsContact O-N 3.08Å; H288-D314 IonicContact CE1-OD2 2.88Å; H288-D314 PolarHBondContact CE1-OD2 3.06Å; H288-D314 IonicContact CG-OD2 3.84Å; H288-D314 IonicContact ND1-OD1 2.76Å; H288-D314 IonicContact ND1-OD2 2.75Å; H288-D314 PolarHBondContact ND1-OD2 3.14Å; D314-H340 WeakPolarHBondContact O-CB 3.41Å; D314-H340 PolarHBondContact O-CD2 3.08Å
315	S	84.1	Confident	92.8	Very high	12 Å²	12	32.8 Å²	32.8	8%	0.084	19%	0.189	C	C	.	.			trans	-96.9	118.7	-179.4	-172.2	0	0	0	0	112.5	I313 S317 A318	I313-S315 VanDerWaalsContact CG2-O 3.3Å; I313-S315 WeakPolarHBondContact CG2-O 3.3Å; S315-S317 PolarHBondContact O-N 3.11Å; S315-S317 PolarHBondContact OG-OG 2.87Å; S315-A318 PolarHBondContact O-N 3.28Å; S315-A318 VanDerWaalsContact O-N 3.17Å
316	S	81.8	Confident	92.8	Very high	58 Å²	58	32.9 Å²	32.9	41%	0.406	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-63.9	-21.8	177.5	56.7	0	0	0	0	113.4	A318	S316-A318 VanDerWaalsContact C-N 3.29Å
317	S	81.9	Confident	92.8	Very high	61 Å²	61	30.7 Å²	30.7	43%	0.427	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-74.2	-19.6	178	59.2	0	0	0	0	113.1	S315 L319	S315-S317 PolarHBondContact O-N 3.11Å; S315-S317 PolarHBondContact OG-OG 2.87Å; S317-L319 VanDerWaalsContact C-N 3.32Å
318	A	84.5	Confident	92.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-83	-7.2	179.5	0	0	0	0	0	113.9	W298 I313 S315 S316	W298-A318 VanDerWaalsContact CD1-CA 3.49Å; W298-A318 HydrophobicContact CD2-CB 3.97Å; W298-A318 HydrophobicContact CG-CB 4.01Å; W298-A318 HydrophobicContact CZ2-CB 4.21Å; I313-A318 HydrophobicContact CD1-CB 4.37Å; I313-A318 HydrophobicContact CG2-CB 3.63Å; S315-A318 PolarHBondContact O-N 3.28Å; S315-A318 VanDerWaalsContact O-N 3.17Å; S316-A318 VanDerWaalsContact C-N 3.29Å
319	L	89.3	Confident	92.7	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	20%	0.197	C	C	.	.			trans	-114.9	51.3	-177.5	-70.9	168.9	0	0	0	112.1	I313 S317 V324 V339 A343 I349	I313-L319 HydrophobicContact CD1-CD2 3.97Å; I313-L319 HydrophobicContact CD1-CG 4.22Å; I313-L319 HydrophobicContact CG2-CD1 4.45Å; I313-L319 HydrophobicContact CG2-CG 4.41Å; S317-L319 VanDerWaalsContact C-N 3.32Å; L319-V324 HydrophobicContact CD2-CG2 4.43Å; L319-V339 HydrophobicContact CD1-CB 3.89Å; L319-V339 HydrophobicContact CD1-CG1 3.45Å; L319-V339 VanDerWaalsContact CD1-CG1 3.45Å; L319-A343 HydrophobicContact CB-CB 4.42Å; L319-A343 HydrophobicContact CD1-CB 3.58Å; L319-I349 HydrophobicContact CB-CG2 4.47Å; L319-I349 WeakPolarHBondContact O-CD1 3.06Å; L319-I349 WeakPolarHBondContact O-CG1 3.23Å
320	T	91.8	Very high	92.7	Very high	63 Å²	63	34.5 Å²	34.5	39%	0.387	20%	0.195	S	C	.	.			trans	-70.4	164.7	171	64.4	0	0	0	0	111.6	D322 C323 V324	T320-D322 VanDerWaalsContact C-N 3.26Å; T320-D322 PolarHBondContact O-N 2.6Å; T320-C323 WeakPolarHBondContact O-CB 3.22Å; T320-C323 PolarHBondContact O-N 3.02Å; T320-C323 PolarHBondContact OG1-SG 3.17Å; T320-V324 PolarHBondContact O-N 2.7Å; T320-V324 VanDerWaalsContact O-N 3.07Å
321	S	92.6	Very high	92.7	Very high	43 Å²	43	31.7 Å²	31.7	30%	0.301	18%	0.182	S	C	.	.	H	α-helix	trans	-47	-49.1	176.5	53.9	0	0	0	0	112.6	C323 V324 D325 R352	S321-C323 VanDerWaalsContact C-N 3.28Å; S321-C323 PolarHBondContact O-N 2.9Å; S321-V324 PolarHBondContact O-N 3.2Å; S321-D325 PolarHBondContact O-N 3.42Å; S321-R352 VanDerWaalsContact C-NH1 3.26Å; S321-R352 VanDerWaalsContact CB-NH1 3.29Å; S321-R352 PolarHBondContact O-NH1 3.12Å
322	D	94.3	Very high	92.6	Very high	99 Å²	99	34.7 Å²	34.7	53%	0.529	20%	0.204	S	C	.	.	H	α-helix	trans	-70.3	-28.2	-175.8	-58.1	0.9	0	0	0	111.9	T320 A326	T320-D322 VanDerWaalsContact C-N 3.26Å; T320-D322 PolarHBondContact O-N 2.6Å; D322-A326 WeakPolarHBondContact O-CB 3.39Å; D322-A326 PolarHBondContact O-N 3.04Å; D322-A326 VanDerWaalsContact O-N 3.07Å
323	C	94.1	Very high	92.8	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.034	22%	0.217	C	C	.	.	H	α-helix	trans	-71.7	-43.4	175.6	-64.5	0	0	0	0	110.9	W298 S299 Y302 T320 S321 D325 A326 L327	W298-C323 HydrophobicContact CB-CB 4.39Å; W298-C323 VanDerWaalsContact CB-SG 3.5Å; S299-C323 PolarHBondContact N-SG 2.88Å; Y302-C323 HydrophobicContact CD2-CB 4.27Å; Y302-C323 HydrophobicContact CE2-CB 3.98Å; T320-C323 WeakPolarHBondContact O-CB 3.22Å; T320-C323 PolarHBondContact O-N 3.02Å; T320-C323 PolarHBondContact OG1-SG 3.17Å; S321-C323 VanDerWaalsContact C-N 3.28Å; S321-C323 PolarHBondContact O-N 2.9Å; C323-D325 VanDerWaalsContact C-N 3.34Å; C323-A326 WeakPolarHBondContact O-CB 3.42Å; C323-A326 PolarHBondContact O-N 3.39Å; C323-L327 WeakPolarHBondContact O-CG 3.24Å; C323-L327 PolarHBondContact O-N 3.14Å
324	V	96	Very high	93	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-37	176.5	-169.9	0	0	0	0	111.2	L319 T320 S321 A326 L327 I328 I349 R352 I353	L319-V324 HydrophobicContact CD2-CG2 4.43Å; T320-V324 PolarHBondContact O-N 2.7Å; T320-V324 VanDerWaalsContact O-N 3.07Å; S321-V324 PolarHBondContact O-N 3.2Å; V324-A326 VanDerWaalsContact C-N 3.32Å; V324-A326 PolarHBondContact O-N 2.89Å; V324-L327 WeakPolarHBondContact O-CB 3.45Å; V324-L327 PolarHBondContact O-N 2.71Å; V324-L327 VanDerWaalsContact O-N 3.17Å; V324-I328 HydrophobicContact CG1-CD1 4.16Å; V324-I328 HydrophobicContact CG1-CG1 4.44Å; V324-I328 VanDerWaalsContact O-CG1 3.3Å; V324-I328 WeakPolarHBondContact O-CG1 3.33Å; V324-I328 PolarHBondContact O-N 3.44Å; V324-I349 HydrophobicContact CG2-CG2 4.13Å; V324-R352 HydrophobicContact CB-CB 3.96Å; V324-R352 HydrophobicContact CG1-CB 3.44Å; V324-R352 VanDerWaalsContact CG1-CB 3.44Å; V324-I353 HydrophobicContact CG1-CG1 4.05Å; V324-I353 HydrophobicContact CG2-CG1 4.28Å
325	D	97.2	Very high	93.5	Very high	50 Å²	50	37.8 Å²	37.8	27%	0.267	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-44.9	172.9	-71.7	-5.2	0	0	0	111.1	S321 C323 L327 I328 E329 R352	S321-D325 PolarHBondContact O-N 3.42Å; C323-D325 VanDerWaalsContact C-N 3.34Å; D325-L327 VanDerWaalsContact C-N 3.3Å; D325-L327 PolarHBondContact O-N 3.07Å; D325-I328 PolarHBondContact O-N 3.24Å; D325-E329 WeakPolarHBondContact O-CB 3.23Å; D325-E329 WeakPolarHBondContact O-CG 3.3Å; D325-E329 PolarHBondContact O-N 3.04Å; D325-R352 WeakPolarHBondContact OD1-CD 3.45Å; D325-R352 IonicContact OD1-CZ 3.88Å; D325-R352 IonicContact OD1-NE 3.63Å; D325-R352 IonicContact OD1-NH1 3.92Å; D325-R352 PolarHBondContact OD1-NH1 3.45Å; D325-R352 IonicContact OD2-CZ 2.74Å; D325-R352 IonicContact OD2-NH1 2.95Å; D325-R352 PolarHBondContact OD2-NH1 2.83Å
326	A	97.1	Very high	94.2	Very high	2 Å²	2	41.2 Å²	41.2	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-40	174.9	0	0	0	0	0	112.5	S299 K303 D322 C323 V324 N330	S299-A326 WeakPolarHBondContact O-CB 3.1Å; K303-A326 HydrophobicContact CG-CB 4.18Å; D322-A326 WeakPolarHBondContact O-CB 3.39Å; D322-A326 PolarHBondContact O-N 3.04Å; D322-A326 VanDerWaalsContact O-N 3.07Å; C323-A326 WeakPolarHBondContact O-CB 3.42Å; C323-A326 PolarHBondContact O-N 3.39Å; V324-A326 VanDerWaalsContact C-N 3.32Å; V324-A326 PolarHBondContact O-N 2.89Å; A326-N330 VanDerWaalsContact O-CB 3.3Å; A326-N330 WeakPolarHBondContact O-CB 3.13Å; A326-N330 PolarHBondContact O-N 3.46Å; A326-N330 PolarHBondContact O-ND2 3.17Å
327	L	97.5	Very high	95	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-45.1	174.7	-68.2	170.5	0	0	0	112	Y302 L308 L311 C323 V324 D325 C331 L334	Y302-L327 HydrophobicContact CD1-CD2 3.44Å; Y302-L327 VanDerWaalsContact CD1-CD2 3.44Å; Y302-L327 HydrophobicContact CD1-CG 4.35Å; Y302-L327 HydrophobicContact CD2-CD1 4.32Å; Y302-L327 HydrophobicContact CD2-CD2 3.71Å; Y302-L327 HydrophobicContact CD2-CG 3.69Å; Y302-L327 HydrophobicContact CE1-CD2 3.95Å; Y302-L327 HydrophobicContact CE2-CD1 4.28Å; Y302-L327 HydrophobicContact CE2-CD2 4.18Å; Y302-L327 HydrophobicContact CE2-CG 4.14Å; Y302-L327 HydrophobicContact CG-CD2 3.35Å; Y302-L327 HydrophobicContact CG-CG 3.84Å; L308-L327 HydrophobicContact CD2-CD2 4.3Å; L311-L327 HydrophobicContact CD2-CD1 3.6Å; L311-L327 HydrophobicContact CD2-CD2 3.77Å; L311-L327 HydrophobicContact CD2-CG 4.37Å; C323-L327 WeakPolarHBondContact O-CG 3.24Å; C323-L327 PolarHBondContact O-N 3.14Å; V324-L327 WeakPolarHBondContact O-CB 3.45Å; V324-L327 PolarHBondContact O-N 2.71Å; V324-L327 VanDerWaalsContact O-N 3.17Å; D325-L327 VanDerWaalsContact C-N 3.3Å; D325-L327 PolarHBondContact O-N 3.07Å; L327-C331 HydrophobicContact CD2-CB 4.43Å; L327-C331 WeakPolarHBondContact O-CA 3.36Å; L327-C331 WeakPolarHBondContact O-CB 3.4Å; L327-C331 PolarHBondContact O-N 3.02Å; L327-L334 HydrophobicContact CB-CD2 4.26Å; L327-L334 HydrophobicContact CD1-CD2 4.41Å; L327-L334 HydrophobicContact CD2-CD2 3.91Å; L327-L334 HydrophobicContact CG-CD2 4.43Å
328	I	97.3	Very high	95.6	Very high	40 Å²	40	38.2 Å²	38.2	21%	0.205	21%	0.207	C	C	.	.	H	α-helix	trans	-62.1	-45.2	179.1	-67.2	164	0	0	0	110.8	V324 D325 R352 R355 I356	V324-I328 HydrophobicContact CG1-CD1 4.16Å; V324-I328 HydrophobicContact CG1-CG1 4.44Å; V324-I328 VanDerWaalsContact O-CG1 3.3Å; V324-I328 WeakPolarHBondContact O-CG1 3.33Å; V324-I328 PolarHBondContact O-N 3.44Å; D325-I328 PolarHBondContact O-N 3.24Å; I328-R352 HydrophobicContact CD1-CB 4.09Å; I328-R352 WeakPolarHBondContact CD1-O 3.4Å; I328-R355 HydrophobicContact CD1-CB 4.07Å; I328-I356 HydrophobicContact CG1-CG1 3.92Å
329	E	97.7	Very high	96.1	Very high	138 Å²	138	38.2 Å²	38.2	65%	0.645	21%	0.207	S	C	*	.	H	α-helix	trans	-75.2	-35.3	-174.4	-71.8	175	178.5	0	0	113	D325	D325-E329 WeakPolarHBondContact O-CB 3.23Å; D325-E329 WeakPolarHBondContact O-CG 3.3Å; D325-E329 PolarHBondContact O-N 3.04Å
330	N	97.9	Very high	96.1	Very high	49 Å²	49	39 Å²	39	26%	0.262	21%	0.21	S	C	.	.	H	α-helix	trans	-114.1	-30.3	-166.7	-57.3	-88.4	0	0	0	113.4	K303 P306 A326 S332	K303-N330 WeakPolarHBondContact CG-ND2 3.03Å; P306-N330 VanDerWaalsContact CA-O 3.3Å; P306-N330 WeakPolarHBondContact CA-O 3.04Å; A326-N330 VanDerWaalsContact O-CB 3.3Å; A326-N330 WeakPolarHBondContact O-CB 3.13Å; A326-N330 PolarHBondContact O-N 3.46Å; A326-N330 PolarHBondContact O-ND2 3.17Å; N330-S332 PolarHBondContact O-N 3.29Å
331	C	97.6	Very high	96	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.			trans	-99.3	62.7	-175.5	-55	0	0	0	0	111	C305 L308 L327 L333 L334	C305-C331 PolarHBondContact O-SG 3.46Å; C305-C331 VanDerWaalsContact O-SG 3.35Å; L308-C331 HydrophobicContact CB-CB 4.34Å; L327-C331 HydrophobicContact CD2-CB 4.43Å; L327-C331 WeakPolarHBondContact O-CA 3.36Å; L327-C331 WeakPolarHBondContact O-CB 3.4Å; L327-C331 PolarHBondContact O-N 3.02Å; C331-L333 PolarHBondContact O-N 3.35Å; C331-L333 VanDerWaalsContact O-N 3.08Å; C331-L334 HydrophobicContact CB-CB 3.92Å; C331-L334 HydrophobicContact CB-CD2 4.37Å; C331-L334 WeakPolarHBondContact O-CB 3.43Å; C331-L334 PolarHBondContact O-N 2.99Å
332	S	97.2	Very high	95.7	Very high	69 Å²	69	38.8 Å²	38.8	48%	0.483	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.8	-176.4	62.6	0	0	0	0	114.3	N330 S358	N330-S332 PolarHBondContact O-N 3.29Å; S332-S358 VanDerWaalsContact O-CB 3.23Å; S332-S358 WeakPolarHBondContact O-CB 3.12Å; S332-S358 PolarHBondContact O-OG 2.93Å
333	L	98.1	Very high	95.3	Very high	70 Å²	70	34.2 Å²	34.2	37%	0.366	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-5.9	175.9	-57.9	-175.7	0	0	0	113.8	L308 E309 C331 S335	L308-L333 CarbonylContact O-C 3.44Å; E309-L333 HydrophobicContact CG-CB 4.08Å; C331-L333 PolarHBondContact O-N 3.35Å; C331-L333 VanDerWaalsContact O-N 3.08Å; L333-S335 PolarHBondContact O-N 3.27Å
334	L	98.4	Very high	94.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.			trans	-65.1	109.5	-173.7	-176.4	61.1	0	0	0	110.6	L308 L311 L327 C331 V337 I356 S358 L359	L308-L334 HydrophobicContact CD2-CD1 4.38Å; L308-L334 HydrophobicContact CG-CD1 4.32Å; L308-L334 VanDerWaalsContact O-CA 3.24Å; L308-L334 WeakPolarHBondContact O-CA 3.47Å; L308-L334 PolarHBondContact O-N 2.77Å; L311-L334 HydrophobicContact CB-CD1 3.76Å; L311-L334 HydrophobicContact CD2-CD2 4.41Å; L327-L334 HydrophobicContact CB-CD2 4.26Å; L327-L334 HydrophobicContact CD1-CD2 4.41Å; L327-L334 HydrophobicContact CD2-CD2 3.91Å; L327-L334 HydrophobicContact CG-CD2 4.43Å; C331-L334 HydrophobicContact CB-CB 3.92Å; C331-L334 HydrophobicContact CB-CD2 4.37Å; C331-L334 WeakPolarHBondContact O-CB 3.43Å; C331-L334 PolarHBondContact O-N 2.99Å; L334-V337 HydrophobicContact CD1-CG2 4.07Å; L334-V337 HydrophobicContact CD2-CG2 3.85Å; L334-V337 HydrophobicContact CG-CG2 3.84Å; L334-I356 HydrophobicContact CB-CG2 4.12Å; L334-I356 HydrophobicContact CD2-CD1 4.1Å; L334-I356 HydrophobicContact CD2-CG2 4.22Å; L334-I356 HydrophobicContact CG-CG2 4.26Å; L334-S358 CarbonylContact O-C 3.48Å; L334-S358 WeakPolarHBondContact O-CB 3.39Å; L334-L359 PolarHBondContact O-N 3.04Å
335	S	98.1	Very high	94.4	Very high	30 Å²	30	39.3 Å²	39.3	21%	0.21	19%	0.194	C	C	.	.			trans	-117.4	-24.7	-171.4	68.6	0	0	0	0	113.4	E309 L333 S358 R360 M361	E309-S335 PolarHBondContact O-N 2.83Å; E309-S335 PolarHBondContact O-OG 2.91Å; L333-S335 PolarHBondContact O-N 3.27Å; S335-S358 VanDerWaalsContact CA-O 3.31Å; S335-S358 WeakPolarHBondContact CA-O 3.32Å; S335-S358 WeakPolarHBondContact CB-O 3.37Å; S335-R360 PolarHBondContact O-N 2.74Å; S335-M361 PolarHBondContact O-N 2.73Å
336	K	98.3	Very high	93.9	Very high	84 Å²	84	39.5 Å²	39.5	37%	0.365	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.8	177.2	-49	-173.4	-169.1	159.3	0	110	E309 E310 L311 M361	E309-K336 PolarHBondContact O-N 2.88Å; E309-K336 VanDerWaalsContact O-N 3.11Å; E310-K336 WeakPolarHBondContact CA-O 3.32Å; E310-K336 HydrophobicContact CB-CB 4.37Å; E310-K336 HydrophobicContact CG-CB 4.16Å; E310-K336 HydrophobicContact CG-CD 3.97Å; E310-K336 HydrophobicContact CG-CG 4.23Å; E310-K336 WeakPolarHBondContact OE1-CD 3.42Å; E310-K336 WeakPolarHBondContact OE1-CE 3.29Å; E310-K336 IonicContact OE1-NZ 2.8Å; E310-K336 PolarHBondContact OE1-NZ 2.86Å; L311-K336 PolarHBondContact N-O 2.96Å; K336-M361 WeakPolarHBondContact CA-O 3.3Å; K336-M361 HydrophobicContact CB-CB 4.25Å; K336-M361 HydrophobicContact CB-SD 4.44Å; K336-M361 HydrophobicContact CD-SD 3.86Å; K336-M361 HydrophobicContact CG-CB 4.03Å; K336-M361 HydrophobicContact CG-SD 4.14Å
337	V	97.3	Very high	93.5	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.03	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.4	177.3	171.2	0	0	0	0	107.9	L311 L334 V339 I356 L359 M361 L362 T363	L311-V337 CarbonylContact O-C 3.59Å; L311-V337 VanDerWaalsContact O-CA 3.29Å; L311-V337 WeakPolarHBondContact O-CA 3.24Å; L334-V337 HydrophobicContact CD1-CG2 4.07Å; L334-V337 HydrophobicContact CD2-CG2 3.85Å; L334-V337 HydrophobicContact CG-CG2 3.84Å; V337-V339 HydrophobicContact CG1-CG1 3.55Å; V337-I356 HydrophobicContact CG2-CD1 4.22Å; V337-L359 HydrophobicContact CB-CD1 3.8Å; V337-L359 HydrophobicContact CG2-CD1 3.64Å; V337-M361 PolarHBondContact N-O 2.91Å; V337-L362 HydrophobicContact CB-CD1 4.18Å; V337-L362 HydrophobicContact CG1-CD1 3.95Å; V337-L362 CarbonylContact O-C 3.47Å; V337-L362 VanDerWaalsContact O-CA 3.31Å; V337-L362 WeakPolarHBondContact O-CA 3.31Å; V337-L362 WeakPolarHBondContact O-CD1 3.47Å; V337-T363 PolarHBondContact O-N 3.18Å
338	K	95.8	Very high	93.2	Very high	50 Å²	50	45.3 Å²	45.3	22%	0.217	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.3	170.7	177.5	176.1	-177.7	-174.5	0	108.1	L311 S312 I313 T363 D365	L311-K338 PolarHBondContact O-N 2.93Å; S312-K338 WeakPolarHBondContact CA-O 3.47Å; S312-K338 WeakPolarHBondContact OG-CD 3.49Å; I313-K338 PolarHBondContact N-O 3.11Å; K338-T363 CarbonylContact C-O 3.58Å; K338-T363 VanDerWaalsContact CA-O 3.24Å; K338-T363 WeakPolarHBondContact CA-O 3.34Å; K338-T363 HydrophobicContact CD-CG2 4.13Å; K338-T363 HydrophobicContact CG-CG2 3.94Å; K338-D365 VanDerWaalsContact CE-CB 3.42Å; K338-D365 WeakPolarHBondContact CE-OD2 3.29Å; K338-D365 IonicContact NZ-OD2 3.68Å; K338-D365 PolarHBondContact NZ-OD2 3.19Å
339	V	93.9	Very high	92.9	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.8	-177	-60	0	0	0	0	111.8	I313 L319 V337 A343 L362 T363 I364 D365	I313-V339 WeakPolarHBondContact O-CA 3.37Å; L319-V339 HydrophobicContact CD1-CB 3.89Å; L319-V339 HydrophobicContact CD1-CG1 3.45Å; L319-V339 VanDerWaalsContact CD1-CG1 3.45Å; V337-V339 HydrophobicContact CG1-CG1 3.55Å; V339-A343 HydrophobicContact CB-CB 4.28Å; V339-L362 HydrophobicContact CG2-CD1 4.16Å; V339-T363 PolarHBondContact N-O 2.88Å; V339-I364 HydrophobicContact CG2-CG1 4.14Å; V339-I364 WeakPolarHBondContact O-CA 3.38Å; V339-D365 PolarHBondContact O-N 3.09Å
340	H	90.9	Very high	92.6	Very high	18 Å²	18	37.9 Å²	37.9	8%	0.083	20%	0.197	C	C	.	.			trans	-66.9	141.9	168.3	-172.3	-79.6	0	0	0	111.6	I313 D314 K342 A343 C366 M370	I313-H340 PolarHBondContact O-N 2.99Å; I313-H340 VanDerWaalsContact O-N 3.14Å; D314-H340 WeakPolarHBondContact O-CB 3.41Å; D314-H340 PolarHBondContact O-CD2 3.08Å; H340-K342 WeakPolarHBondContact ND1-CB 3.43Å; H340-K342 PolarHBondContact ND1-N 3.29Å; H340-K342 VanDerWaalsContact ND1-N 3.13Å; H340-K342 PolarHBondContact O-N 3.19Å; H340-K342 VanDerWaalsContact O-N 3.09Å; H340-A343 VanDerWaalsContact O-CB 3.24Å; H340-A343 WeakPolarHBondContact O-CB 3.49Å; H340-A343 PolarHBondContact O-N 3.47Å; H340-C366 PolarHBondContact NE2-SG 2.81Å; H340-C366 VanDerWaalsContact NE2-SG 3.38Å; H340-M370 WeakPolarHBondContact CE1-CE 3.41Å; H340-M370 VanDerWaalsContact CE1-SD 3.54Å; H340-M370 WeakPolarHBondContact NE2-CE 3.3Å
341	P	87.6	Confident	92.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-54.4	-34.7	-177	-26.3	29.2	0	0	0	114.8	A343 L344 I364 D365 C366 F373 V396	P341-A343 PolarHBondContact O-N 2.92Å; P341-L344 WeakPolarHBondContact O-CA 3.31Å; P341-L344 WeakPolarHBondContact O-CB 3.25Å; P341-L344 PolarHBondContact O-N 3.13Å; P341-I364 HydrophobicContact CB-CG2 4.1Å; P341-I364 HydrophobicContact CG-CG2 3.9Å; P341-D365 VanDerWaalsContact CD-O 3.23Å; P341-D365 WeakPolarHBondContact CD-O 3.34Å; P341-C366 HydrophobicContact CG-CB 3.7Å; P341-F373 HydrophobicContact CB-CE1 4.48Å; P341-V396 HydrophobicContact CB-CG2 4.2Å; P341-V396 HydrophobicContact CG-CG2 3.59Å
342	K	87.9	Confident	92.2	Very high	102 Å²	102	42.6 Å²	42.6	44%	0.443	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-57.7	-27.6	175.3	-73.7	173.5	179.1	169.7	0	113.8	H340 L344 Y345 M370	H340-K342 WeakPolarHBondContact ND1-CB 3.43Å; H340-K342 PolarHBondContact ND1-N 3.29Å; H340-K342 VanDerWaalsContact ND1-N 3.13Å; H340-K342 PolarHBondContact O-N 3.19Å; H340-K342 VanDerWaalsContact O-N 3.09Å; K342-L344 PolarHBondContact O-N 2.9Å; K342-Y345 HydrophobicContact CB-CD2 4.47Å; K342-Y345 HydrophobicContact CG-CD2 4.31Å; K342-Y345 HydrophobicContact CG-CE2 4.01Å; K342-Y345 WeakPolarHBondContact O-CB 3.42Å; K342-Y345 PolarHBondContact O-N 2.75Å; K342-M370 HydrophobicContact CD-CE 4.37Å; K342-M370 HydrophobicContact CD-SD 4.32Å; K342-M370 HydrophobicContact CG-SD 3.99Å
343	A	85.8	Confident	92.1	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-62.4	-23.4	173.8	0	0	0	0	0	111.7	L319 V339 H340 P341	L319-A343 HydrophobicContact CB-CB 4.42Å; L319-A343 HydrophobicContact CD1-CB 3.58Å; V339-A343 HydrophobicContact CB-CB 4.28Å; H340-A343 VanDerWaalsContact O-CB 3.24Å; H340-A343 WeakPolarHBondContact O-CB 3.49Å; H340-A343 PolarHBondContact O-N 3.47Å; P341-A343 PolarHBondContact O-N 2.92Å
344	L	84.1	Confident	92	Very high	6 Å²	6	36.4 Å²	36.4	3%	0.031	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-88.6	2.2	179.8	-57.1	-179.4	0	0	0	114.7	P341 K342 C346 V350 I353 I364 F373	P341-L344 WeakPolarHBondContact O-CA 3.31Å; P341-L344 WeakPolarHBondContact O-CB 3.25Å; P341-L344 PolarHBondContact O-N 3.13Å; K342-L344 PolarHBondContact O-N 2.9Å; L344-C346 VanDerWaalsContact C-N 3.29Å; L344-V350 HydrophobicContact CB-CG2 3.87Å; L344-V350 HydrophobicContact CD2-CB 4.26Å; L344-V350 HydrophobicContact CD2-CG1 4.17Å; L344-V350 HydrophobicContact CD2-CG2 3.51Å; L344-V350 HydrophobicContact CG-CG2 4.29Å; L344-V350 WeakPolarHBondContact O-CG2 3.43Å; L344-I353 HydrophobicContact CD2-CD1 4.41Å; L344-I364 HydrophobicContact CD1-CB 4.37Å; L344-I364 HydrophobicContact CD1-CD1 3.26Å; L344-I364 HydrophobicContact CD1-CG1 3.6Å; L344-I364 HydrophobicContact CD1-CG2 3.87Å; L344-F373 HydrophobicContact CB-CD1 4.01Å; L344-F373 HydrophobicContact CB-CE1 4.25Å; L344-F373 HydrophobicContact CD1-CD1 3.91Å; L344-F373 HydrophobicContact CD1-CE1 3.46Å; L344-F373 VanDerWaalsContact CD1-CE1 3.46Å; L344-F373 HydrophobicContact CD1-CZ 4.18Å; L344-F373 HydrophobicContact CG-CE1 4.44Å
345	Y	86.3	Confident	91.8	Very high	106 Å²	106	42.3 Å²	42.3	42%	0.416	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-78.1	-16.1	174.5	-67.6	-7.4	0	0	0	113	K342 N371	K342-Y345 HydrophobicContact CB-CD2 4.47Å; K342-Y345 HydrophobicContact CG-CD2 4.31Å; K342-Y345 HydrophobicContact CG-CE2 4.01Å; K342-Y345 WeakPolarHBondContact O-CB 3.42Å; K342-Y345 PolarHBondContact O-N 2.75Å; Y345-N371 PolarHBondContact OH-O 3.38Å
346	C	88	Confident	91.8	Very high	55 Å²	55	41.1 Å²	41.1	37%	0.372	19%	0.189	S	C	.	.			trans	-100.1	107.4	174	-176.5	0	0	0	0	109.7	L344 E348 I349 V350	L344-C346 VanDerWaalsContact C-N 3.29Å; C346-E348 PolarHBondContact O-N 3.01Å; C346-E348 VanDerWaalsContact O-N 3.13Å; C346-I349 HydrophobicContact CB-CB 4.03Å; C346-I349 HydrophobicContact CB-CD1 3.59Å; C346-I349 HydrophobicContact CB-CG1 3.94Å; C346-I349 PolarHBondContact O-N 3.47Å; C346-V350 WeakPolarHBondContact O-CG2 3.43Å; C346-V350 PolarHBondContact O-N 3.06Å; C346-V350 VanDerWaalsContact O-N 3.07Å
347	S	87.5	Confident	91.7	Very high	56 Å²	56	39.7 Å²	39.7	39%	0.392	19%	0.188	S	C	.	.	H	α-helix	trans	-54.1	-33.1	179.5	56.5	0	0	0	0	113.2	R351	S347-R351 VanDerWaalsContact O-CB 3.29Å; S347-R351 WeakPolarHBondContact O-CB 2.95Å; S347-R351 PolarHBondContact O-N 2.91Å
348	E	91.2	Very high	91.7	Very high	69 Å²	69	41.5 Å²	41.5	32%	0.322	20%	0.201	S	C	.	.	H	α-helix	trans	-68.5	-44.8	177	-175.8	59.6	-166.7	0	0	112.3	C346 V350 R351 R352	C346-E348 PolarHBondContact O-N 3.01Å; C346-E348 VanDerWaalsContact O-N 3.13Å; E348-V350 VanDerWaalsContact C-N 3.33Å; E348-V350 PolarHBondContact O-N 3.07Å; E348-R351 PolarHBondContact O-N 2.62Å; E348-R352 VanDerWaalsContact O-CG 3.28Å; E348-R352 WeakPolarHBondContact O-CG 3.24Å; E348-R352 PolarHBondContact O-N 2.8Å; E348-R352 IonicContact OE1-CZ 3.12Å; E348-R352 VanDerWaalsContact OE1-CZ 3.26Å; E348-R352 IonicContact OE1-NE 2.69Å; E348-R352 PolarHBondContact OE1-NE 3.31Å; E348-R352 IonicContact OE1-NH2 3.87Å; E348-R352 PolarHBondContact OE1-NH2 3.13Å
349	I	92.2	Very high	91.8	Very high	22 Å²	22	39.4 Å²	39.4	11%	0.113	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-46.2	176.2	-70.4	166.6	0	0	0	109.7	L319 V324 C346 R351 R352 I353	L319-I349 HydrophobicContact CB-CG2 4.47Å; L319-I349 WeakPolarHBondContact O-CD1 3.06Å; L319-I349 WeakPolarHBondContact O-CG1 3.23Å; V324-I349 HydrophobicContact CG2-CG2 4.13Å; C346-I349 HydrophobicContact CB-CB 4.03Å; C346-I349 HydrophobicContact CB-CD1 3.59Å; C346-I349 HydrophobicContact CB-CG1 3.94Å; C346-I349 PolarHBondContact O-N 3.47Å; I349-R351 PolarHBondContact O-N 2.91Å; I349-R352 PolarHBondContact O-N 3.27Å; I349-R352 VanDerWaalsContact O-N 3.12Å; I349-I353 HydrophobicContact CG2-CD1 3.89Å; I349-I353 HydrophobicContact CG2-CG1 4.39Å; I349-I353 WeakPolarHBondContact O-CG1 3.36Å; I349-I353 PolarHBondContact O-N 2.88Å
350	V	90.3	Very high	92	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-46.4	-180	179.3	0	0	0	0	111.7	L344 C346 E348 R352 I353 G354 A377 F381	L344-V350 HydrophobicContact CB-CG2 3.87Å; L344-V350 HydrophobicContact CD2-CB 4.26Å; L344-V350 HydrophobicContact CD2-CG1 4.17Å; L344-V350 HydrophobicContact CD2-CG2 3.51Å; L344-V350 HydrophobicContact CG-CG2 4.29Å; L344-V350 WeakPolarHBondContact O-CG2 3.43Å; C346-V350 WeakPolarHBondContact O-CG2 3.43Å; C346-V350 PolarHBondContact O-N 3.06Å; C346-V350 VanDerWaalsContact O-N 3.07Å; E348-V350 VanDerWaalsContact C-N 3.33Å; E348-V350 PolarHBondContact O-N 3.07Å; V350-R352 PolarHBondContact O-N 2.98Å; V350-I353 PolarHBondContact O-N 2.88Å; V350-G354 PolarHBondContact O-N 3.23Å; V350-G354 VanDerWaalsContact O-N 3.16Å; V350-A377 VanDerWaalsContact CG1-O 3.3Å; V350-A377 WeakPolarHBondContact CG1-O 3.39Å; V350-A377 HydrophobicContact CG2-CB 4.2Å; V350-F381 HydrophobicContact CG1-CB 3.35Å; V350-F381 HydrophobicContact CG1-CD2 3.87Å; V350-F381 HydrophobicContact CG1-CG 3.93Å
351	R	92.1	Very high	92.3	Very high	107 Å²	107	47.2 Å²	47.2	40%	0.404	22%	0.223	S	C	.	.	H	α-helix	trans	-59	-37.7	176.2	-173.2	-179.5	-176.9	175	3	111.6	S347 E348 I349 R355 I380 V384	S347-R351 VanDerWaalsContact O-CB 3.29Å; S347-R351 WeakPolarHBondContact O-CB 2.95Å; S347-R351 PolarHBondContact O-N 2.91Å; E348-R351 PolarHBondContact O-N 2.62Å; I349-R351 PolarHBondContact O-N 2.91Å; R351-R355 WeakPolarHBondContact O-CG 3.4Å; R351-I380 HydrophobicContact CB-CG2 3.67Å; R351-I380 HydrophobicContact CG-CG2 3.72Å; R351-V384 HydrophobicContact CG-CG1 4.22Å
352	R	95.2	Very high	92.8	Very high	40 Å²	40	47.2 Å²	47.2	15%	0.151	22%	0.223	C	C	.	.	H	α-helix	trans	-73.6	-41.9	178.3	-69.5	173.5	-176.2	-146.2	-0.6	112	S321 V324 D325 I328 E348 I349 V350 G354 R355	S321-R352 VanDerWaalsContact C-NH1 3.26Å; S321-R352 VanDerWaalsContact CB-NH1 3.29Å; S321-R352 PolarHBondContact O-NH1 3.12Å; V324-R352 HydrophobicContact CB-CB 3.96Å; V324-R352 HydrophobicContact CG1-CB 3.44Å; V324-R352 VanDerWaalsContact CG1-CB 3.44Å; D325-R352 WeakPolarHBondContact OD1-CD 3.45Å; D325-R352 IonicContact OD1-CZ 3.88Å; D325-R352 IonicContact OD1-NE 3.63Å; D325-R352 IonicContact OD1-NH1 3.92Å; D325-R352 PolarHBondContact OD1-NH1 3.45Å; D325-R352 IonicContact OD2-CZ 2.74Å; D325-R352 IonicContact OD2-NH1 2.95Å; D325-R352 PolarHBondContact OD2-NH1 2.83Å; I328-R352 HydrophobicContact CD1-CB 4.09Å; I328-R352 WeakPolarHBondContact CD1-O 3.4Å; E348-R352 VanDerWaalsContact O-CG 3.28Å; E348-R352 WeakPolarHBondContact O-CG 3.24Å; E348-R352 PolarHBondContact O-N 2.8Å; E348-R352 IonicContact OE1-CZ 3.12Å; E348-R352 VanDerWaalsContact OE1-CZ 3.26Å; E348-R352 IonicContact OE1-NE 2.69Å; E348-R352 PolarHBondContact OE1-NE 3.31Å; E348-R352 IonicContact OE1-NH2 3.87Å; E348-R352 PolarHBondContact OE1-NH2 3.13Å; I349-R352 PolarHBondContact O-N 3.27Å; I349-R352 VanDerWaalsContact O-N 3.12Å; V350-R352 PolarHBondContact O-N 2.98Å; R352-G354 VanDerWaalsContact C-N 3.27Å; R352-G354 PolarHBondContact O-N 2.75Å; R352-R355 WeakPolarHBondContact O-CA 3.4Å; R352-R355 WeakPolarHBondContact O-CB 3.28Å; R352-R355 PolarHBondContact O-N 2.88Å
353	I	95.4	Very high	93.1	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-56	-45.6	176.3	-69.5	169.9	0	0	0	110.3	V324 L344 I349 V350 R355 I356 L359 L362 F381	V324-I353 HydrophobicContact CG1-CG1 4.05Å; V324-I353 HydrophobicContact CG2-CG1 4.28Å; L344-I353 HydrophobicContact CD2-CD1 4.41Å; I349-I353 HydrophobicContact CG2-CD1 3.89Å; I349-I353 HydrophobicContact CG2-CG1 4.39Å; I349-I353 WeakPolarHBondContact O-CG1 3.36Å; I349-I353 PolarHBondContact O-N 2.88Å; V350-I353 PolarHBondContact O-N 2.88Å; I353-R355 PolarHBondContact O-N 2.9Å; I353-R355 VanDerWaalsContact O-N 3.09Å; I353-I356 HydrophobicContact CG2-CD1 4.31Å; I353-I356 WeakPolarHBondContact O-CB 3.19Å; I353-I356 WeakPolarHBondContact O-CD1 3.34Å; I353-I356 VanDerWaalsContact O-CG1 3.29Å; I353-I356 WeakPolarHBondContact O-CG1 3.31Å; I353-I356 PolarHBondContact O-N 3.29Å; I353-L359 HydrophobicContact CG2-CD2 4Å; I353-L359 WeakPolarHBondContact O-CD2 3.5Å; I353-L362 HydrophobicContact CG2-CD1 4.38Å; I353-F381 HydrophobicContact CG2-CE2 4.26Å
354	G	94.5	Very high	93.4	Very high	8 Å²	8	43.1 Å²	43.1	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-9.1	177.9	0	0	0	0	0	115.2	V350 R352 V384	V350-G354 PolarHBondContact O-N 3.23Å; V350-G354 VanDerWaalsContact O-N 3.16Å; R352-G354 VanDerWaalsContact C-N 3.27Å; R352-G354 PolarHBondContact O-N 2.75Å; G354-V384 CarbonylContact O-C 3.25Å
355	R	95.9	Very high	93.6	Very high	123 Å²	123	44.5 Å²	44.5	46%	0.464	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-5.7	173.1	-71	172.5	169.4	175.4	-4.3	113.7	I328 R351 R352 I353 P357	I328-R355 HydrophobicContact CD1-CB 4.07Å; R351-R355 WeakPolarHBondContact O-CG 3.4Å; R352-R355 WeakPolarHBondContact O-CA 3.4Å; R352-R355 WeakPolarHBondContact O-CB 3.28Å; R352-R355 PolarHBondContact O-N 2.88Å; I353-R355 PolarHBondContact O-N 2.9Å; I353-R355 VanDerWaalsContact O-N 3.09Å; R355-P357 WeakPolarHBondContact O-CD 3.38Å; R355-P357 VanDerWaalsContact O-N 3.13Å
356	I	97.3	Very high	93.5	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.031	20%	0.195	C	C	.	.			trans	-57.4	117.9	176.7	-67.5	167.4	0	0	0	108.7	I328 L334 V337 I353 S358 L359	I328-I356 HydrophobicContact CG1-CG1 3.92Å; L334-I356 HydrophobicContact CB-CG2 4.12Å; L334-I356 HydrophobicContact CD2-CD1 4.1Å; L334-I356 HydrophobicContact CD2-CG2 4.22Å; L334-I356 HydrophobicContact CG-CG2 4.26Å; V337-I356 HydrophobicContact CG2-CD1 4.22Å; I353-I356 HydrophobicContact CG2-CD1 4.31Å; I353-I356 WeakPolarHBondContact O-CB 3.19Å; I353-I356 WeakPolarHBondContact O-CD1 3.34Å; I353-I356 VanDerWaalsContact O-CG1 3.29Å; I353-I356 WeakPolarHBondContact O-CG1 3.31Å; I353-I356 PolarHBondContact O-N 3.29Å; I356-S358 VanDerWaalsContact C-N 3.27Å; I356-S358 PolarHBondContact O-N 3.09Å; I356-S358 VanDerWaalsContact O-N 3.11Å; I356-L359 HydrophobicContact CB-CB 3.89Å; I356-L359 HydrophobicContact CG2-CB 3.93Å; I356-L359 WeakPolarHBondContact O-CB 3.34Å; I356-L359 PolarHBondContact O-N 2.96Å
357	P	95.7	Very high	93	Very high	54 Å²	54	41.2 Å²	41.2	35%	0.351	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-31.9	-163.6	-29.3	35.7	0	0	0	115.4	R355 K387	R355-P357 WeakPolarHBondContact O-CD 3.38Å; R355-P357 VanDerWaalsContact O-N 3.13Å; P357-K387 VanDerWaalsContact O-CD 3.25Å; P357-K387 WeakPolarHBondContact O-CD 3.46Å; P357-K387 PolarHBondContact O-NZ 3.06Å
358	S	97.5	Very high	92.6	Very high	43 Å²	43	45.1 Å²	45.1	30%	0.301	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	5.8	-175.1	-68.1	0	0	0	0	113.7	S332 L334 S335 I356 R360	S332-S358 VanDerWaalsContact O-CB 3.23Å; S332-S358 WeakPolarHBondContact O-CB 3.12Å; S332-S358 PolarHBondContact O-OG 2.93Å; L334-S358 CarbonylContact O-C 3.48Å; L334-S358 WeakPolarHBondContact O-CB 3.39Å; S335-S358 VanDerWaalsContact CA-O 3.31Å; S335-S358 WeakPolarHBondContact CA-O 3.32Å; S335-S358 WeakPolarHBondContact CB-O 3.37Å; I356-S358 VanDerWaalsContact C-N 3.27Å; I356-S358 PolarHBondContact O-N 3.09Å; I356-S358 VanDerWaalsContact O-N 3.11Å; S358-R360 PolarHBondContact O-N 3.46Å
359	L	98	Very high	91.8	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	23%	0.234	C	C	.	.			trans	-62.4	118.9	-177.1	-176.1	66.4	0	0	0	111.3	L334 V337 I353 I356 M361 L388	L334-L359 PolarHBondContact O-N 3.04Å; V337-L359 HydrophobicContact CB-CD1 3.8Å; V337-L359 HydrophobicContact CG2-CD1 3.64Å; I353-L359 HydrophobicContact CG2-CD2 4Å; I353-L359 WeakPolarHBondContact O-CD2 3.5Å; I356-L359 HydrophobicContact CB-CB 3.89Å; I356-L359 HydrophobicContact CG2-CB 3.93Å; I356-L359 WeakPolarHBondContact O-CB 3.34Å; I356-L359 PolarHBondContact O-N 2.96Å; L359-M361 WeakPolarHBondContact CD1-O 3.46Å; L359-L388 HydrophobicContact CD2-CD1 4.3Å; L359-L388 HydrophobicContact CG-CD1 4.02Å
360	R	98.1	Very high	91.2	Very high	132 Å²	132	47.5 Å²	47.5	50%	0.498	24%	0.237	S	C	.	.			trans	-120.7	-28.7	178	-69.2	179.5	-172.6	-132.3	12.2	112.7	S335 S358 E389 V390	S335-R360 PolarHBondContact O-N 2.74Å; S358-R360 PolarHBondContact O-N 3.46Å; R360-E389 HydrophobicContact CB-CB 4.48Å; R360-E389 IonicContact CZ-OE1 3.8Å; R360-E389 IonicContact NE-OE1 3.43Å; R360-E389 IonicContact NH1-OE1 2.74Å; R360-E389 PolarHBondContact NH1-OE1 3.48Å; R360-E389 IonicContact NH1-OE2 3.32Å; R360-E389 PolarHBondContact NH1-OE2 2.87Å; R360-E389 PolarHBondContact O-N 2.88Å; R360-V390 PolarHBondContact O-N 3.03Å
361	M	98.2	Very high	90.6	Very high	50 Å²	50	53.5 Å²	53.5	25%	0.246	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124	-179.7	179.6	177.2	-76.3	0	0	109.9	S335 K336 V337 L359 V390	S335-M361 PolarHBondContact O-N 2.73Å; K336-M361 WeakPolarHBondContact CA-O 3.3Å; K336-M361 HydrophobicContact CB-CB 4.25Å; K336-M361 HydrophobicContact CB-SD 4.44Å; K336-M361 HydrophobicContact CD-SD 3.86Å; K336-M361 HydrophobicContact CG-CB 4.03Å; K336-M361 HydrophobicContact CG-SD 4.14Å; V337-M361 PolarHBondContact N-O 2.91Å; L359-M361 WeakPolarHBondContact CD1-O 3.46Å; M361-V390 WeakPolarHBondContact CA-O 3.24Å; M361-V390 HydrophobicContact CB-CB 4.12Å; M361-V390 HydrophobicContact CE-CB 3.88Å; M361-V390 HydrophobicContact CE-CG1 3.82Å; M361-V390 HydrophobicContact CE-CG2 3.83Å; M361-V390 HydrophobicContact CG-CB 3.98Å; M361-V390 HydrophobicContact CG-CG1 4.14Å
362	L	96.8	Very high	89.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	120.5	169.1	179.7	66.8	0	0	0	108.6	V337 V339 I353 I364 F381 L388 V390 L391 D392	V337-L362 HydrophobicContact CB-CD1 4.18Å; V337-L362 HydrophobicContact CG1-CD1 3.95Å; V337-L362 CarbonylContact O-C 3.47Å; V337-L362 VanDerWaalsContact O-CA 3.31Å; V337-L362 WeakPolarHBondContact O-CA 3.31Å; V337-L362 WeakPolarHBondContact O-CD1 3.47Å; V339-L362 HydrophobicContact CG2-CD1 4.16Å; I353-L362 HydrophobicContact CG2-CD1 4.38Å; L362-I364 HydrophobicContact CD1-CG1 4.47Å; L362-I364 HydrophobicContact CD2-CD1 3.92Å; L362-I364 HydrophobicContact CD2-CG1 4.1Å; L362-I364 HydrophobicContact CG-CD1 4.29Å; L362-I364 HydrophobicContact CG-CG1 4.02Å; L362-F381 HydrophobicContact CB-CZ 4.36Å; L362-F381 HydrophobicContact CD2-CD1 4.5Å; L362-F381 HydrophobicContact CD2-CD2 4.5Å; L362-F381 HydrophobicContact CD2-CE1 3.63Å; L362-F381 HydrophobicContact CD2-CE2 3.63Å; L362-F381 HydrophobicContact CD2-CZ 3.14Å; L362-F381 HydrophobicContact CG-CZ 4.33Å; L362-L388 HydrophobicContact CB-CD1 3.84Å; L362-L388 HydrophobicContact CB-CD2 4.31Å; L362-V390 PolarHBondContact N-O 2.9Å; L362-L391 HydrophobicContact CB-CD1 4.21Å; L362-L391 HydrophobicContact CD2-CD1 4.26Å; L362-L391 HydrophobicContact CG-CD1 4.41Å; L362-L391 WeakPolarHBondContact O-CA 3.44Å; L362-D392 PolarHBondContact O-N 2.98Å
363	T	95.1	Very high	88.8	Confident	20 Å²	20	47.4 Å²	47.4	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.6	169.6	-60.4	0	0	0	0	108.9	V337 K338 V339 D365 D392	V337-T363 PolarHBondContact O-N 3.18Å; K338-T363 CarbonylContact C-O 3.58Å; K338-T363 VanDerWaalsContact CA-O 3.24Å; K338-T363 WeakPolarHBondContact CA-O 3.34Å; K338-T363 HydrophobicContact CD-CG2 4.13Å; K338-T363 HydrophobicContact CG-CG2 3.94Å; V339-T363 PolarHBondContact N-O 2.88Å; T363-D365 HydrophobicContact CG2-CB 4.01Å; T363-D392 HydrophobicContact CG2-CB 4.05Å
364	I	91.9	Very high	88.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	106.9	174.6	-55.4	152.1	0	0	0	105.9	V339 P341 L344 L362 F373 L391 D392 F393 D394 V396	V339-I364 HydrophobicContact CG2-CG1 4.14Å; V339-I364 WeakPolarHBondContact O-CA 3.38Å; P341-I364 HydrophobicContact CB-CG2 4.1Å; P341-I364 HydrophobicContact CG-CG2 3.9Å; L344-I364 HydrophobicContact CD1-CB 4.37Å; L344-I364 HydrophobicContact CD1-CD1 3.26Å; L344-I364 HydrophobicContact CD1-CG1 3.6Å; L344-I364 HydrophobicContact CD1-CG2 3.87Å; L362-I364 HydrophobicContact CD1-CG1 4.47Å; L362-I364 HydrophobicContact CD2-CD1 3.92Å; L362-I364 HydrophobicContact CD2-CG1 4.1Å; L362-I364 HydrophobicContact CG-CD1 4.29Å; L362-I364 HydrophobicContact CG-CG1 4.02Å; I364-F373 HydrophobicContact CB-CZ 4.44Å; I364-F373 HydrophobicContact CD1-CE1 4.34Å; I364-F373 HydrophobicContact CD1-CZ 3.96Å; I364-F373 HydrophobicContact CG2-CE1 3.9Å; I364-F373 HydrophobicContact CG2-CZ 3.94Å; I364-L391 HydrophobicContact CD1-CD1 4.4Å; I364-D392 PolarHBondContact N-O 2.82Å; I364-F393 HydrophobicContact CB-CD1 4.4Å; I364-F393 HydrophobicContact CD1-CD1 3.7Å; I364-F393 HydrophobicContact CD1-CE1 3.33Å; I364-F393 HydrophobicContact CD1-CZ 4.39Å; I364-D394 VanDerWaalsContact O-O 3.05Å; I364-V396 HydrophobicContact CB-CG2 4.43Å; I364-V396 HydrophobicContact CG2-CG2 3.81Å
365	D	88.3	Confident	87.8	Confident	34 Å²	34	54.1 Å²	54.1	18%	0.182	28%	0.282	C	S	.	.			trans	-135.4	145.5	-169.2	-179.3	20.1	0	0	0	110.1	K338 V339 P341 T363 D394 H395	K338-D365 VanDerWaalsContact CE-CB 3.42Å; K338-D365 WeakPolarHBondContact CE-OD2 3.29Å; K338-D365 IonicContact NZ-OD2 3.68Å; K338-D365 PolarHBondContact NZ-OD2 3.19Å; V339-D365 PolarHBondContact O-N 3.09Å; P341-D365 VanDerWaalsContact CD-O 3.23Å; P341-D365 WeakPolarHBondContact CD-O 3.34Å; T363-D365 HydrophobicContact CG2-CB 4.01Å; D365-D394 WeakPolarHBondContact CA-O 3.46Å; D365-H395 IonicContact OD1-CD2 2.73Å; D365-H395 PolarHBondContact OD1-CD2 3.1Å; D365-H395 VanDerWaalsContact OD1-CD2 3.23Å
366	C	84.8	Confident	87.3	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.014	29%	0.285	C	S	.	.			trans	-143.6	137.5	176.8	-174.2	0	0	0	0	109.5	H340 P341 E368 H395	H340-C366 PolarHBondContact NE2-SG 2.81Å; H340-C366 VanDerWaalsContact NE2-SG 3.38Å; P341-C366 HydrophobicContact CG-CB 3.7Å; C366-E368 WeakPolarHBondContact CB-O 3.44Å; C366-E368 PolarHBondContact O-N 3.18Å; C366-E368 PolarHBondContact SG-N 3.37Å; C366-E368 PolarHBondContact SG-O 2.88Å; C366-H395 WeakPolarHBondContact O-CB 3.49Å
367	P	76.4	Confident	86.9	Confident	90 Å²	90	52 Å²	52	58%	0.584	28%	0.284	S	S	*	.	S	Bend	trans	-60.7	-18.4	173.9	24.6	-34.9	0	0	0	113.7
368	E	80.5	Confident	86.6	Confident	139 Å²	139	49.7 Å²	49.7	65%	0.65	27%	0.268	S	S	*	.	S	Bend	trans	-129	137.9	179.3	-63.7	-178.7	178.4	0	0	111.1	C366 M370	C366-E368 WeakPolarHBondContact CB-O 3.44Å; C366-E368 PolarHBondContact O-N 3.18Å; C366-E368 PolarHBondContact SG-N 3.37Å; C366-E368 PolarHBondContact SG-O 2.88Å; E368-M370 PolarHBondContact O-N 3.21Å; E368-M370 VanDerWaalsContact O-N 3.09Å
369	P	73.6	Confident	86.3	Confident	104 Å²	104	50.8 Å²	50.8	68%	0.675	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-59.9	118.5	179.4	23.1	-31.8	0	0	0	110.8
370	M	78.7	Confident	85.9	Confident	37 Å²	37	53 Å²	53	18%	0.182	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-102.3	154.7	179.4	-72.4	-149.8	-179.4	0	0	112.9	H340 K342 E368 G372	H340-M370 WeakPolarHBondContact CE1-CE 3.41Å; H340-M370 VanDerWaalsContact CE1-SD 3.54Å; H340-M370 WeakPolarHBondContact NE2-CE 3.3Å; K342-M370 HydrophobicContact CD-CE 4.37Å; K342-M370 HydrophobicContact CD-SD 4.32Å; K342-M370 HydrophobicContact CG-SD 3.99Å; E368-M370 PolarHBondContact O-N 3.21Å; E368-M370 VanDerWaalsContact O-N 3.09Å; M370-G372 PolarHBondContact O-N 3.21Å
371	N	77.8	Confident	85.6	Confident	127 Å²	127	46.8 Å²	46.8	68%	0.679	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-57.9	136.9	168.7	-71.9	-32	0	0	0	109.4	Y345	Y345-N371 PolarHBondContact OH-O 3.38Å
372	G	72.4	Confident	85.3	Confident	14 Å²	14	44.4 Å²	44.4	14%	0.144	24%	0.244	C	C	.	.			trans	-58.4	179.7	-168	0	0	0	0	0	116.1	M370 R397	M370-G372 PolarHBondContact O-N 3.21Å; G372-R397 WeakPolarHBondContact CA-O 3.5Å
373	F	76.8	Confident	85.2	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.018	27%	0.266	C	S	.	.			trans	-66.3	155.6	-177.9	-53.7	-64.2	0	0	0	113.4	P341 L344 I364 E375 F378 F393 V396 V398	P341-F373 HydrophobicContact CB-CE1 4.48Å; L344-F373 HydrophobicContact CB-CD1 4.01Å; L344-F373 HydrophobicContact CB-CE1 4.25Å; L344-F373 HydrophobicContact CD1-CD1 3.91Å; L344-F373 HydrophobicContact CD1-CE1 3.46Å; L344-F373 VanDerWaalsContact CD1-CE1 3.46Å; L344-F373 HydrophobicContact CD1-CZ 4.18Å; L344-F373 HydrophobicContact CG-CE1 4.44Å; I364-F373 HydrophobicContact CB-CZ 4.44Å; I364-F373 HydrophobicContact CD1-CE1 4.34Å; I364-F373 HydrophobicContact CD1-CZ 3.96Å; I364-F373 HydrophobicContact CG2-CE1 3.9Å; I364-F373 HydrophobicContact CG2-CZ 3.94Å; F373-E375 PolarHBondContact O-N 3.13Å; F373-F378 HydrophobicContact CB-CB 4.17Å; F373-F378 HydrophobicContact CD2-CD2 4.24Å; F373-F378 HydrophobicContact CG-CD2 4.42Å; F373-F393 AromaticContact CE2-CD1 3.64Å; F373-F393 HydrophobicContact CE2-CD1 3.64Å; F373-F393 AromaticContact CE2-CE1 3.5Å; F373-F393 HydrophobicContact CE2-CE1 3.5Å; F373-F393 HydrophobicContact CE2-CZ 4.46Å; F373-F393 AromaticContact CZ-CD1 3.69Å; F373-F393 HydrophobicContact CZ-CD1 3.69Å; F373-F393 AromaticContact CZ-CE1 3.7Å; F373-F393 HydrophobicContact CZ-CE1 3.7Å; F373-V396 HydrophobicContact CD1-CG1 4.3Å; F373-V396 HydrophobicContact CD2-CG1 4.18Å; F373-V396 HydrophobicContact CE1-CB 4.48Å; F373-V396 HydrophobicContact CE1-CG1 3.61Å; F373-V396 HydrophobicContact CE2-CB 4.13Å; F373-V396 HydrophobicContact CE2-CG1 3.49Å; F373-V396 VanDerWaalsContact CE2-CG1 3.49Å; F373-V396 HydrophobicContact CZ-CB 3.74Å; F373-V396 HydrophobicContact CZ-CG1 3.18Å; F373-V396 HydrophobicContact CZ-CG2 4Å; F373-V398 HydrophobicContact CE2-CG2 4.31Å
374	D	84	Confident	85.1	Confident	75 Å²	75	48.7 Å²	48.7	40%	0.401	27%	0.271	S	S	.	.			trans	-64.9	121.8	154.5	-178.5	-96.6	0	0	0	108.4	V376 A377 F378	D374-V376 VanDerWaalsContact C-N 3.31Å; D374-V376 PolarHBondContact O-N 2.9Å; D374-V376 WeakPolarHBondContact OD1-CB 3.49Å; D374-V376 PolarHBondContact OD1-N 3.07Å; D374-A377 HydrophobicContact CB-CB 3.94Å; D374-A377 PolarHBondContact O-N 3.09Å; D374-A377 WeakPolarHBondContact OD1-CB 3.18Å; D374-A377 PolarHBondContact OD1-N 3.06Å; D374-F378 PolarHBondContact O-N 3.09Å
375	E	85.1	Confident	85.2	Confident	76 Å²	76	49 Å²	49	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-42.3	-173.2	177.9	-175	157.2	0	0	111.5	F373 F378 E379 E401	F373-E375 PolarHBondContact O-N 3.13Å; E375-F378 PolarHBondContact O-N 3.26Å; E375-E379 WeakPolarHBondContact O-CB 3.2Å; E375-E379 PolarHBondContact O-N 2.86Å; E375-E401 HydrophobicContact CG-CB 3.59Å; E375-E401 WeakPolarHBondContact OE1-CB 3.38Å; E375-E401 WeakPolarHBondContact OE1-CG 3.23Å; E375-E401 WeakPolarHBondContact OE2-CB 3.37Å
376	V	87.3	Confident	85.5	Confident	85 Å²	85	50.7 Å²	50.7	52%	0.515	29%	0.287	S	S	.	.	H	α-helix	trans	-67.6	-44.9	-177.9	-179.4	0	0	0	0	110	D374 F378 E379 I380	D374-V376 VanDerWaalsContact C-N 3.31Å; D374-V376 PolarHBondContact O-N 2.9Å; D374-V376 WeakPolarHBondContact OD1-CB 3.49Å; D374-V376 PolarHBondContact OD1-N 3.07Å; V376-F378 VanDerWaalsContact C-N 3.32Å; V376-F378 PolarHBondContact O-N 3.36Å; V376-E379 PolarHBondContact O-N 2.88Å; V376-I380 HydrophobicContact CG1-CD1 3.9Å; V376-I380 WeakPolarHBondContact O-CB 3.29Å; V376-I380 WeakPolarHBondContact O-CD1 3.5Å; V376-I380 WeakPolarHBondContact O-CG1 3.36Å; V376-I380 PolarHBondContact O-N 3.27Å
377	A	87.2	Confident	86	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-58.1	-45.2	175.1	0	0	0	0	0	111.7	V350 D374 I380 F381	V350-A377 VanDerWaalsContact CG1-O 3.3Å; V350-A377 WeakPolarHBondContact CG1-O 3.39Å; V350-A377 HydrophobicContact CG2-CB 4.2Å; D374-A377 HydrophobicContact CB-CB 3.94Å; D374-A377 PolarHBondContact O-N 3.09Å; D374-A377 WeakPolarHBondContact OD1-CB 3.18Å; D374-A377 PolarHBondContact OD1-N 3.06Å; A377-I380 PolarHBondContact O-N 3.24Å; A377-F381 PolarHBondContact O-N 2.68Å
378	F	89.8	Confident	87	Confident	5 Å²	5	51.5 Å²	51.5	2%	0.022	28%	0.282	C	S	.	.	H	α-helix	trans	-70	-36.7	-179.6	-170.8	-98	0	0	0	113.1	F373 D374 E375 V376 F381 C382 L391 F393 C402 L406	F373-F378 HydrophobicContact CB-CB 4.17Å; F373-F378 HydrophobicContact CD2-CD2 4.24Å; F373-F378 HydrophobicContact CG-CD2 4.42Å; D374-F378 PolarHBondContact O-N 3.09Å; E375-F378 PolarHBondContact O-N 3.26Å; V376-F378 VanDerWaalsContact C-N 3.32Å; V376-F378 PolarHBondContact O-N 3.36Å; F378-F381 HydrophobicContact CE2-CD1 4.05Å; F378-F381 VanDerWaalsContact O-CB 3.26Å; F378-F381 WeakPolarHBondContact O-CB 3.41Å; F378-F381 PolarHBondContact O-N 3.09Å; F378-C382 WeakPolarHBondContact CE1-SG 3.45Å; F378-C382 WeakPolarHBondContact CZ-SG 3.29Å; F378-C382 PolarHBondContact O-N 3.39Å; F378-C382 VanDerWaalsContact O-N 3.08Å; F378-C382 PolarHBondContact O-SG 2.96Å; F378-L391 HydrophobicContact CZ-CD2 4.5Å; F378-F393 HydrophobicContact CE1-CZ 4.47Å; F378-F393 AromaticContact CE2-CE1 3.71Å; F378-F393 HydrophobicContact CE2-CE1 3.71Å; F378-F393 AromaticContact CE2-CZ 3.39Å; F378-F393 HydrophobicContact CE2-CZ 3.39Å; F378-F393 HydrophobicContact CZ-CE1 4.16Å; F378-F393 HydrophobicContact CZ-CE2 4.24Å; F378-F393 AromaticContact CZ-CZ 3.38Å; F378-F393 HydrophobicContact CZ-CZ 3.38Å; F378-C402 HydrophobicContact CD1-CB 3.53Å; F378-C402 HydrophobicContact CE1-CB 4.08Å; F378-C402 VanDerWaalsContact CE1-O 3.22Å; F378-C402 WeakPolarHBondContact CE1-O 3.46Å; F378-C402 HydrophobicContact CG-CB 4.15Å; F378-L406 HydrophobicContact CE1-CD2 4Å; F378-L406 HydrophobicContact CZ-CD2 3.77Å
379	E	90.6	Very high	87.9	Confident	65 Å²	65	47.7 Å²	47.7	30%	0.304	26%	0.264	S	S	.	.	H	α-helix	trans	-62.4	-45.1	172.3	-175.7	-172.1	156.6	0	0	111.3	E375 V376 F381 C382 T383 R408	E375-E379 WeakPolarHBondContact O-CB 3.2Å; E375-E379 PolarHBondContact O-N 2.86Å; V376-E379 PolarHBondContact O-N 2.88Å; E379-F381 VanDerWaalsContact C-N 3.3Å; E379-F381 PolarHBondContact O-N 2.83Å; E379-C382 PolarHBondContact O-N 3.28Å; E379-T383 PolarHBondContact O-N 2.77Å; E379-T383 VanDerWaalsContact O-N 3.11Å; E379-T383 PolarHBondContact O-OG1 2.94Å; E379-R408 VanDerWaalsContact CG-NH1 3.33Å; E379-R408 IonicContact OE1-CZ 3.11Å; E379-R408 IonicContact OE1-NH1 2.84Å; E379-R408 PolarHBondContact OE1-NH1 2.9Å; E379-R408 IonicContact OE1-NH2 2.65Å; E379-R408 PolarHBondContact OE1-NH2 2.96Å
380	I	89.9	Confident	89	Confident	52 Å²	52	43.7 Å²	43.7	27%	0.267	24%	0.237	S	C	.	.	H	α-helix	trans	-58.4	-45.4	175.7	-69.1	165.8	0	0	0	109.7	R351 V376 A377 C382 T383 V384	R351-I380 HydrophobicContact CB-CG2 3.67Å; R351-I380 HydrophobicContact CG-CG2 3.72Å; V376-I380 HydrophobicContact CG1-CD1 3.9Å; V376-I380 WeakPolarHBondContact O-CB 3.29Å; V376-I380 WeakPolarHBondContact O-CD1 3.5Å; V376-I380 WeakPolarHBondContact O-CG1 3.36Å; V376-I380 PolarHBondContact O-N 3.27Å; A377-I380 PolarHBondContact O-N 3.24Å; I380-C382 PolarHBondContact O-N 3.26Å; I380-T383 WeakPolarHBondContact O-CB 3.35Å; I380-T383 PolarHBondContact O-N 2.88Å; I380-T383 VanDerWaalsContact O-N 3.17Å; I380-V384 WeakPolarHBondContact O-CG2 3.07Å; I380-V384 PolarHBondContact O-N 3.13Å; I380-V384 VanDerWaalsContact O-N 3.16Å
381	F	91.5	Very high	89.9	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.009	23%	0.229	C	C	.	.	H	α-helix	trans	-50.8	-55.2	174.8	-177.9	-112.4	0	0	0	112	V350 I353 L362 A377 F378 E379 T383 V384 A385 L388	V350-F381 HydrophobicContact CG1-CB 3.35Å; V350-F381 HydrophobicContact CG1-CD2 3.87Å; V350-F381 HydrophobicContact CG1-CG 3.93Å; I353-F381 HydrophobicContact CG2-CE2 4.26Å; L362-F381 HydrophobicContact CB-CZ 4.36Å; L362-F381 HydrophobicContact CD2-CD1 4.5Å; L362-F381 HydrophobicContact CD2-CD2 4.5Å; L362-F381 HydrophobicContact CD2-CE1 3.63Å; L362-F381 HydrophobicContact CD2-CE2 3.63Å; L362-F381 HydrophobicContact CD2-CZ 3.14Å; L362-F381 HydrophobicContact CG-CZ 4.33Å; A377-F381 PolarHBondContact O-N 2.68Å; F378-F381 HydrophobicContact CE2-CD1 4.05Å; F378-F381 VanDerWaalsContact O-CB 3.26Å; F378-F381 WeakPolarHBondContact O-CB 3.41Å; F378-F381 PolarHBondContact O-N 3.09Å; E379-F381 VanDerWaalsContact C-N 3.3Å; E379-F381 PolarHBondContact O-N 2.83Å; F381-T383 PolarHBondContact O-N 3.04Å; F381-T383 VanDerWaalsContact O-N 3.16Å; F381-V384 VanDerWaalsContact O-CG2 3.24Å; F381-V384 WeakPolarHBondContact O-CG2 3.24Å; F381-V384 PolarHBondContact O-N 3.06Å; F381-V384 VanDerWaalsContact O-N 3.07Å; F381-A385 HydrophobicContact CD1-CB 4.42Å; F381-A385 HydrophobicContact CD2-CB 4.25Å; F381-A385 HydrophobicContact CE1-CB 3.95Å; F381-A385 HydrophobicContact CE2-CB 3.75Å; F381-A385 HydrophobicContact CZ-CB 3.55Å; F381-A385 VanDerWaalsContact O-CB 3.27Å; F381-A385 WeakPolarHBondContact O-CB 3.23Å; F381-A385 PolarHBondContact O-N 3.34Å; F381-L388 HydrophobicContact CE1-CD2 3.91Å; F381-L388 HydrophobicContact CZ-CD2 4Å
382	C	93.4	Very high	90.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-24.9	-174	-65.1	0	0	0	0	112.1	F378 E379 I380 S405 R408 L409	F378-C382 WeakPolarHBondContact CE1-SG 3.45Å; F378-C382 WeakPolarHBondContact CZ-SG 3.29Å; F378-C382 PolarHBondContact O-N 3.39Å; F378-C382 VanDerWaalsContact O-N 3.08Å; F378-C382 PolarHBondContact O-SG 2.96Å; E379-C382 PolarHBondContact O-N 3.28Å; I380-C382 PolarHBondContact O-N 3.26Å; C382-S405 VanDerWaalsContact CB-O 3.28Å; C382-S405 WeakPolarHBondContact CB-O 3.41Å; C382-R408 HydrophobicContact CB-CB 4.07Å; C382-R408 VanDerWaalsContact O-CB 3.29Å; C382-R408 WeakPolarHBondContact O-CB 3.36Å; C382-L409 HydrophobicContact CB-CD2 4.26Å; C382-L409 HydrophobicContact CB-CG 4.19Å
383	T	93.1	Very high	91.5	Very high	74 Å²	74	35.8 Å²	35.8	45%	0.454	19%	0.192	S	C	.	.	H	α-helix	trans	-72.9	-39.3	175.9	-51.4	0	0	0	0	111.8	E379 I380 F381 R408	E379-T383 PolarHBondContact O-N 2.77Å; E379-T383 VanDerWaalsContact O-N 3.11Å; E379-T383 PolarHBondContact O-OG1 2.94Å; I380-T383 WeakPolarHBondContact O-CB 3.35Å; I380-T383 PolarHBondContact O-N 2.88Å; I380-T383 VanDerWaalsContact O-N 3.17Å; F381-T383 PolarHBondContact O-N 3.04Å; F381-T383 VanDerWaalsContact O-N 3.16Å; T383-R408 WeakPolarHBondContact OG1-CD 3.3Å; T383-R408 PolarHBondContact OG1-NH1 3.46Å
384	V	93.6	Very high	91.9	Very high	37 Å²	37	37 Å²	37	22%	0.224	20%	0.199	C	C	.	.	H	α-helix	trans	-87.9	-33.8	-177.5	-65.4	0	0	0	0	113.1	R351 G354 I380 F381 S386	R351-V384 HydrophobicContact CG-CG1 4.22Å; G354-V384 CarbonylContact O-C 3.25Å; I380-V384 WeakPolarHBondContact O-CG2 3.07Å; I380-V384 PolarHBondContact O-N 3.13Å; I380-V384 VanDerWaalsContact O-N 3.16Å; F381-V384 VanDerWaalsContact O-CG2 3.24Å; F381-V384 WeakPolarHBondContact O-CG2 3.24Å; F381-V384 PolarHBondContact O-N 3.06Å; F381-V384 VanDerWaalsContact O-N 3.07Å; V384-S386 PolarHBondContact O-N 2.95Å
385	A	94.6	Very high	91.9	Very high	5 Å²	5	35.2 Å²	35.2	4%	0.041	19%	0.188	C	C	.	.			trans	-78.2	44.5	-174.7	0	0	0	0	0	113.7	F381 K387 L388 L409	F381-A385 HydrophobicContact CD1-CB 4.42Å; F381-A385 HydrophobicContact CD2-CB 4.25Å; F381-A385 HydrophobicContact CE1-CB 3.95Å; F381-A385 HydrophobicContact CE2-CB 3.75Å; F381-A385 HydrophobicContact CZ-CB 3.55Å; F381-A385 VanDerWaalsContact O-CB 3.27Å; F381-A385 WeakPolarHBondContact O-CB 3.23Å; F381-A385 PolarHBondContact O-N 3.34Å; A385-K387 PolarHBondContact O-N 3.16Å; A385-L388 HydrophobicContact CB-CB 4.32Å; A385-L388 WeakPolarHBondContact O-CB 3.35Å; A385-L388 PolarHBondContact O-N 2.75Å; A385-L409 HydrophobicContact CB-CD2 4.01Å; A385-L409 WeakPolarHBondContact O-CD2 3.47Å
386	S	93.6	Very high	91.9	Very high	70 Å²	70	31.6 Å²	31.6	49%	0.49	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-15.1	-174.9	61.9	0	0	0	0	115.4	V384	V384-S386 PolarHBondContact O-N 2.95Å
387	K	96.2	Very high	91.8	Very high	107 Å²	107	33.2 Å²	33.2	47%	0.465	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-5.8	178.4	-63.7	-176.4	-173.5	179	0	114	P357 A385 E389	P357-K387 VanDerWaalsContact O-CD 3.25Å; P357-K387 WeakPolarHBondContact O-CD 3.46Å; P357-K387 PolarHBondContact O-NZ 3.06Å; A385-K387 PolarHBondContact O-N 3.16Å; K387-E389 PolarHBondContact O-N 3.01Å
388	L	97.9	Very high	91.8	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	17%	0.17	C	C	.	.			trans	-64.9	127.4	-174.6	-159.5	75.2	0	0	0	111.1	L359 L362 F381 A385 L391 L409 K411 L412	L359-L388 HydrophobicContact CD2-CD1 4.3Å; L359-L388 HydrophobicContact CG-CD1 4.02Å; L362-L388 HydrophobicContact CB-CD1 3.84Å; L362-L388 HydrophobicContact CB-CD2 4.31Å; F381-L388 HydrophobicContact CE1-CD2 3.91Å; F381-L388 HydrophobicContact CZ-CD2 4Å; A385-L388 HydrophobicContact CB-CB 4.32Å; A385-L388 WeakPolarHBondContact O-CB 3.35Å; A385-L388 PolarHBondContact O-N 2.75Å; L388-L391 HydrophobicContact CD2-CB 3.97Å; L388-L391 HydrophobicContact CD2-CD1 3.98Å; L388-L391 HydrophobicContact CD2-CD2 4.37Å; L388-L391 HydrophobicContact CD2-CG 4.34Å; L388-L409 HydrophobicContact CB-CD2 4.22Å; L388-L409 HydrophobicContact CD2-CD1 4.11Å; L388-L409 HydrophobicContact CD2-CD2 4.39Å; L388-K411 CarbonylContact O-C 3.55Å; L388-K411 VanDerWaalsContact O-C 3.22Å; L388-L412 PolarHBondContact O-N 2.91Å
389	E	98.3	Very high	91.8	Very high	59 Å²	59	37.9 Å²	37.9	28%	0.276	19%	0.189	S	C	.	.			trans	-107.7	-33.8	-178.6	-69	171.4	-171.7	0	0	111.5	R360 K387 K411 T413 T414	R360-E389 HydrophobicContact CB-CB 4.48Å; R360-E389 IonicContact CZ-OE1 3.8Å; R360-E389 IonicContact NE-OE1 3.43Å; R360-E389 IonicContact NH1-OE1 2.74Å; R360-E389 PolarHBondContact NH1-OE1 3.48Å; R360-E389 IonicContact NH1-OE2 3.32Å; R360-E389 PolarHBondContact NH1-OE2 2.87Å; R360-E389 PolarHBondContact O-N 2.88Å; K387-E389 PolarHBondContact O-N 3.01Å; E389-K411 WeakPolarHBondContact CA-O 3.45Å; E389-T413 PolarHBondContact O-N 3.07Å; E389-T413 PolarHBondContact O-OG1 3.16Å; E389-T413 VanDerWaalsContact O-OG1 3.09Å; E389-T414 PolarHBondContact O-N 2.87Å
390	V	98	Very high	91.9	Very high	20 Å²	20	37.9 Å²	37.9	12%	0.121	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.5	179.2	-173.2	0	0	0	0	110.1	R360 M361 L362 T414	R360-V390 PolarHBondContact O-N 3.03Å; M361-V390 WeakPolarHBondContact CA-O 3.24Å; M361-V390 HydrophobicContact CB-CB 4.12Å; M361-V390 HydrophobicContact CE-CB 3.88Å; M361-V390 HydrophobicContact CE-CG1 3.82Å; M361-V390 HydrophobicContact CE-CG2 3.83Å; M361-V390 HydrophobicContact CG-CB 3.98Å; M361-V390 HydrophobicContact CG-CG1 4.14Å; L362-V390 PolarHBondContact N-O 2.9Å; V390-T414 WeakPolarHBondContact CA-O 3.43Å; V390-T414 HydrophobicContact CG1-CG2 3.85Å
391	L	96.5	Very high	92	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	128.4	174.4	-178	58.6	0	0	0	109.4	L362 I364 F378 L388 F393 L406 L409 L412 T414 L415 R416	L362-L391 HydrophobicContact CB-CD1 4.21Å; L362-L391 HydrophobicContact CD2-CD1 4.26Å; L362-L391 HydrophobicContact CG-CD1 4.41Å; L362-L391 WeakPolarHBondContact O-CA 3.44Å; I364-L391 HydrophobicContact CD1-CD1 4.4Å; F378-L391 HydrophobicContact CZ-CD2 4.5Å; L388-L391 HydrophobicContact CD2-CB 3.97Å; L388-L391 HydrophobicContact CD2-CD1 3.98Å; L388-L391 HydrophobicContact CD2-CD2 4.37Å; L388-L391 HydrophobicContact CD2-CG 4.34Å; L391-F393 HydrophobicContact CD1-CE1 4.05Å; L391-F393 HydrophobicContact CD1-CE2 4.08Å; L391-F393 HydrophobicContact CD1-CZ 3.69Å; L391-F393 HydrophobicContact CD2-CD2 4.36Å; L391-F393 HydrophobicContact CD2-CE2 3.33Å; L391-F393 HydrophobicContact CD2-CZ 3.44Å; L391-F393 VanDerWaalsContact CD2-CZ 3.44Å; L391-F393 HydrophobicContact CG-CD2 4.09Å; L391-F393 HydrophobicContact CG-CE1 4.36Å; L391-F393 HydrophobicContact CG-CE2 3.47Å; L391-F393 VanDerWaalsContact CG-CE2 3.47Å; L391-F393 HydrophobicContact CG-CZ 3.61Å; L391-L406 HydrophobicContact CD2-CD2 3.45Å; L391-L406 VanDerWaalsContact CD2-CD2 3.45Å; L391-L409 HydrophobicContact CD2-CD1 3.68Å; L391-L412 HydrophobicContact CB-CD1 3.57Å; L391-T414 PolarHBondContact N-O 2.96Å; L391-L415 HydrophobicContact CB-CD1 4.38Å; L391-L415 HydrophobicContact CD2-CD1 4.5Å; L391-L415 HydrophobicContact CG-CD1 4.47Å; L391-L415 WeakPolarHBondContact O-CA 3.3Å; L391-R416 PolarHBondContact O-N 3.22Å
392	D	95	Very high	92	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.053	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.2	-175	-172.3	-20.7	0	0	0	109.6	L362 T363 I364 D394 R416	L362-D392 PolarHBondContact O-N 2.98Å; T363-D392 HydrophobicContact CG2-CB 4.05Å; I364-D392 PolarHBondContact N-O 2.82Å; D392-D394 PolarHBondContact OD1-N 2.88Å; D392-D394 VanDerWaalsContact OD1-N 3.13Å; D392-R416 HydrophobicContact CB-CB 3.99Å; D392-R416 HydrophobicContact CB-CG 4.5Å; D392-R416 WeakPolarHBondContact OD2-CD 3.4Å; D392-R416 IonicContact OD2-NH1 3.45Å
393	F	89.6	Confident	92	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	19%	0.189	C	C	.	.			trans	-115.7	30.4	-177	-70.2	-61.3	0	0	0	113	I364 F373 F378 L391 H395 V396 V398 L406 L415 R416 N420	I364-F393 HydrophobicContact CB-CD1 4.4Å; I364-F393 HydrophobicContact CD1-CD1 3.7Å; I364-F393 HydrophobicContact CD1-CE1 3.33Å; I364-F393 HydrophobicContact CD1-CZ 4.39Å; F373-F393 AromaticContact CE2-CD1 3.64Å; F373-F393 HydrophobicContact CE2-CD1 3.64Å; F373-F393 AromaticContact CE2-CE1 3.5Å; F373-F393 HydrophobicContact CE2-CE1 3.5Å; F373-F393 HydrophobicContact CE2-CZ 4.46Å; F373-F393 AromaticContact CZ-CD1 3.69Å; F373-F393 HydrophobicContact CZ-CD1 3.69Å; F373-F393 AromaticContact CZ-CE1 3.7Å; F373-F393 HydrophobicContact CZ-CE1 3.7Å; F378-F393 HydrophobicContact CE1-CZ 4.47Å; F378-F393 AromaticContact CE2-CE1 3.71Å; F378-F393 HydrophobicContact CE2-CE1 3.71Å; F378-F393 AromaticContact CE2-CZ 3.39Å; F378-F393 HydrophobicContact CE2-CZ 3.39Å; F378-F393 HydrophobicContact CZ-CE1 4.16Å; F378-F393 HydrophobicContact CZ-CE2 4.24Å; F378-F393 AromaticContact CZ-CZ 3.38Å; F378-F393 HydrophobicContact CZ-CZ 3.38Å; L391-F393 HydrophobicContact CD1-CE1 4.05Å; L391-F393 HydrophobicContact CD1-CE2 4.08Å; L391-F393 HydrophobicContact CD1-CZ 3.69Å; L391-F393 HydrophobicContact CD2-CD2 4.36Å; L391-F393 HydrophobicContact CD2-CE2 3.33Å; L391-F393 HydrophobicContact CD2-CZ 3.44Å; L391-F393 VanDerWaalsContact CD2-CZ 3.44Å; L391-F393 HydrophobicContact CG-CD2 4.09Å; L391-F393 HydrophobicContact CG-CE1 4.36Å; L391-F393 HydrophobicContact CG-CE2 3.47Å; L391-F393 VanDerWaalsContact CG-CE2 3.47Å; L391-F393 HydrophobicContact CG-CZ 3.61Å; F393-H395 PolarHBondContact O-N 3.05Å; F393-V396 PolarHBondContact O-N 2.76Å; F393-V398 HydrophobicContact CB-CG2 4.19Å; F393-V398 HydrophobicContact CD1-CG2 4.42Å; F393-V398 HydrophobicContact CD2-CG2 4.19Å; F393-V398 HydrophobicContact CG-CG2 4.05Å; F393-L406 HydrophobicContact CE2-CD2 4.19Å; F393-L415 HydrophobicContact CD2-CD1 4.23Å; F393-L415 HydrophobicContact CE2-CD1 4.34Å; F393-R416 PolarHBondContact N-O 2.94Å; F393-N420 PolarHBondContact O-ND2 2.9Å; F393-N420 PolarHBondContact O-OD1 2.84Å
394	D	84	Confident	92.1	Very high	29 Å²	29	41.5 Å²	41.5	16%	0.155	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	131.6	178	-74	-4.9	0	0	0	111.5	I364 D365 D392 V396 G418 H444	I364-D394 VanDerWaalsContact O-O 3.05Å; D365-D394 WeakPolarHBondContact CA-O 3.46Å; D392-D394 PolarHBondContact OD1-N 2.88Å; D392-D394 VanDerWaalsContact OD1-N 3.13Å; D394-V396 VanDerWaalsContact C-N 3.31Å; D394-V396 PolarHBondContact O-N 3.03Å; D394-G418 CarbonylContact C-O 3.22Å; D394-G418 WeakPolarHBondContact CA-O 3.27Å; D394-G418 WeakPolarHBondContact OD1-CA 3.22Å; D394-G418 PolarHBondContact OD1-N 3.07Å; D394-H444 IonicContact OD1-CD2 3.81Å; D394-H444 IonicContact OD2-CD2 3.75Å
395	H	84.7	Confident	92.2	Very high	38 Å²	38	40.1 Å²	40.1	18%	0.176	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	17.3	179.5	-53.3	-84.1	0	0	0	117	D365 C366 F393 G418 W419 N420	D365-H395 IonicContact OD1-CD2 2.73Å; D365-H395 PolarHBondContact OD1-CD2 3.1Å; D365-H395 VanDerWaalsContact OD1-CD2 3.23Å; C366-H395 WeakPolarHBondContact O-CB 3.49Å; F393-H395 PolarHBondContact O-N 3.05Å; H395-G418 PolarHBondContact N-O 3.01Å; H395-W419 WeakPolarHBondContact CE1-CB 3.32Å; H395-W419 AromaticContact CE1-CD1 3.49Å; H395-W419 VanDerWaalsContact CE1-CD1 3.49Å; H395-W419 AromaticContact CE1-CD2 3.47Å; H395-W419 VanDerWaalsContact CE1-CD2 3.47Å; H395-W419 AromaticContact CE1-CE2 3.99Å; H395-W419 AromaticContact CE1-CG 3.16Å; H395-W419 AromaticContact CE1-NE1 3.98Å; H395-W419 WeakPolarHBondContact ND1-CB 3.42Å; H395-W419 AromaticContact ND1-CG 3.56Å; H395-W419 AromaticContact NE2-CD1 3.62Å; H395-W419 AromaticContact NE2-CG 3.75Å; H395-N420 VanDerWaalsContact C-OD1 3.3Å; H395-N420 WeakPolarHBondContact CA-OD1 3.46Å; H395-N420 PolarHBondContact N-OD1 3.29Å
396	V	85.7	Confident	92.2	Very high	1 Å²	1	40 Å²	40	1%	0.006	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-114.5	124.6	172.1	-163.6	0	0	0	0	115.6	P341 I364 F373 F393 D394 V398 N420	P341-V396 HydrophobicContact CB-CG2 4.2Å; P341-V396 HydrophobicContact CG-CG2 3.59Å; I364-V396 HydrophobicContact CB-CG2 4.43Å; I364-V396 HydrophobicContact CG2-CG2 3.81Å; F373-V396 HydrophobicContact CD1-CG1 4.3Å; F373-V396 HydrophobicContact CD2-CG1 4.18Å; F373-V396 HydrophobicContact CE1-CB 4.48Å; F373-V396 HydrophobicContact CE1-CG1 3.61Å; F373-V396 HydrophobicContact CE2-CB 4.13Å; F373-V396 HydrophobicContact CE2-CG1 3.49Å; F373-V396 VanDerWaalsContact CE2-CG1 3.49Å; F373-V396 HydrophobicContact CZ-CB 3.74Å; F373-V396 HydrophobicContact CZ-CG1 3.18Å; F373-V396 HydrophobicContact CZ-CG2 4Å; F393-V396 PolarHBondContact O-N 2.76Å; D394-V396 VanDerWaalsContact C-N 3.31Å; D394-V396 PolarHBondContact O-N 3.03Å; V396-V398 PolarHBondContact O-N 3.41Å; V396-N420 WeakPolarHBondContact CA-OD1 3.36Å; V396-N420 PolarHBondContact N-OD1 3Å; V396-N420 PolarHBondContact O-ND2 2.99Å; V396-N420 PolarHBondContact O-OD1 2.9Å
397	R	85.8	Confident	92.4	Very high	119 Å²	119	38 Å²	38	45%	0.449	17%	0.174	S	C	.	.			trans	-66.9	101.6	173.3	-172.7	173.3	-176.4	-176.4	3.1	112	G372 T421	G372-R397 WeakPolarHBondContact CA-O 3.5Å; R397-T421 WeakPolarHBondContact CD-OG1 3.46Å; R397-T421 WeakPolarHBondContact CG-OG1 3.34Å; R397-T421 PolarHBondContact NE-OG1 3.42Å
398	V	87.1	Confident	92.3	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.036	17%	0.171	C	C	.	.			trans	-81.4	129.1	175.1	-172.4	0	0	0	0	110.8	F373 F393 V396 C402 A403 M422 V426	F373-V398 HydrophobicContact CE2-CG2 4.31Å; F393-V398 HydrophobicContact CB-CG2 4.19Å; F393-V398 HydrophobicContact CD1-CG2 4.42Å; F393-V398 HydrophobicContact CD2-CG2 4.19Å; F393-V398 HydrophobicContact CG-CG2 4.05Å; V396-V398 PolarHBondContact O-N 3.41Å; V398-C402 HydrophobicContact CG1-CB 3.88Å; V398-A403 HydrophobicContact CG1-CB 4.33Å; V398-M422 HydrophobicContact CB-CE 3.98Å; V398-M422 HydrophobicContact CG2-CE 4.08Å; V398-V426 HydrophobicContact CB-CG1 4.18Å; V398-V426 HydrophobicContact CG1-CG1 4.18Å; V398-V426 WeakPolarHBondContact O-CG1 3.33Å; V398-V426 WeakPolarHBondContact O-CG2 3.32Å
399	K	89.8	Confident	92.3	Very high	98 Å²	98	38.2 Å²	38.2	43%	0.426	17%	0.172	S	C	.	.			trans	-82.9	159.4	172.5	-65.8	176.9	-178.7	164.6	0	111.3	E401 C402 A403	K399-E401 PolarHBondContact O-N 3.38Å; K399-C402 WeakPolarHBondContact O-CB 3.43Å; K399-C402 PolarHBondContact O-N 2.85Å; K399-A403 PolarHBondContact O-N 3Å
400	K	92	Very high	92.2	Very high	65 Å²	65	43.5 Å²	43.5	28%	0.283	19%	0.194	S	C	.	.	H	α-helix	trans	-58.1	-39.2	-179.1	-63.9	-176.1	-164.3	-173.7	0	111.8	A403 R404 E425 V426 S429	K400-A403 WeakPolarHBondContact O-CB 3.4Å; K400-A403 PolarHBondContact O-N 3.16Å; K400-R404 WeakPolarHBondContact O-CG 3.31Å; K400-R404 PolarHBondContact O-N 3.19Å; K400-E425 HydrophobicContact CD-CB 4.02Å; K400-E425 WeakPolarHBondContact CE-OE2 3.43Å; K400-E425 VanDerWaalsContact NZ-CB 3.33Å; K400-E425 IonicContact NZ-OE2 2.64Å; K400-E425 PolarHBondContact NZ-OE2 3.3Å; K400-V426 HydrophobicContact CG-CG2 4.01Å; K400-S429 WeakPolarHBondContact O-CB 3.34Å
401	E	91.5	Very high	92.1	Very high	63 Å²	63	48.1 Å²	48.1	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-70.1	-38.6	-177.9	-60.3	71.1	-148.9	0	0	111.6	E375 K399 R404 S405	E375-E401 HydrophobicContact CG-CB 3.59Å; E375-E401 WeakPolarHBondContact OE1-CB 3.38Å; E375-E401 WeakPolarHBondContact OE1-CG 3.23Å; E375-E401 WeakPolarHBondContact OE2-CB 3.37Å; K399-E401 PolarHBondContact O-N 3.38Å; E401-R404 PolarHBondContact O-N 3.28Å; E401-S405 PolarHBondContact O-N 3.47Å; E401-S405 PolarHBondContact O-OG 3.33Å
402	C	91.1	Very high	92.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-45	170.2	-61.3	0	0	0	0	110.9	F378 V398 K399 R404 S405	F378-C402 HydrophobicContact CD1-CB 3.53Å; F378-C402 HydrophobicContact CE1-CB 4.08Å; F378-C402 VanDerWaalsContact CE1-O 3.22Å; F378-C402 WeakPolarHBondContact CE1-O 3.46Å; F378-C402 HydrophobicContact CG-CB 4.15Å; V398-C402 HydrophobicContact CG1-CB 3.88Å; K399-C402 WeakPolarHBondContact O-CB 3.43Å; K399-C402 PolarHBondContact O-N 2.85Å; C402-R404 VanDerWaalsContact C-N 3.28Å; C402-R404 PolarHBondContact O-N 3.04Å; C402-S405 VanDerWaalsContact O-CB 3.31Å; C402-S405 WeakPolarHBondContact O-CB 3.5Å; C402-S405 PolarHBondContact O-N 2.87Å
403	A	93.7	Very high	92.4	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-37.1	177.9	0	0	0	0	0	112.8	V398 K399 K400 S405 L406 V426 I430 P431	V398-A403 HydrophobicContact CG1-CB 4.33Å; K399-A403 PolarHBondContact O-N 3Å; K400-A403 WeakPolarHBondContact O-CB 3.4Å; K400-A403 PolarHBondContact O-N 3.16Å; A403-S405 VanDerWaalsContact C-N 3.28Å; A403-S405 PolarHBondContact O-N 3.34Å; A403-L406 WeakPolarHBondContact O-CB 3.47Å; A403-L406 WeakPolarHBondContact O-CG 2.94Å; A403-L406 PolarHBondContact O-N 3.35Å; A403-V426 HydrophobicContact CB-CG1 3.93Å; A403-V426 WeakPolarHBondContact CB-O 3.37Å; A403-I430 HydrophobicContact CB-CG1 3.87Å; A403-P431 WeakPolarHBondContact O-CD 3.49Å
404	R	95.4	Very high	92.7	Very high	139 Å²	139	50.6 Å²	50.6	53%	0.525	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-35.5	173.8	-71	176.9	-170.4	144.6	3.4	112.6	K400 E401 C402 L406 G407 S429 P431	K400-R404 WeakPolarHBondContact O-CG 3.31Å; K400-R404 PolarHBondContact O-N 3.19Å; E401-R404 PolarHBondContact O-N 3.28Å; C402-R404 VanDerWaalsContact C-N 3.28Å; C402-R404 PolarHBondContact O-N 3.04Å; R404-L406 PolarHBondContact O-N 3.13Å; R404-G407 PolarHBondContact O-N 3.33Å; R404-S429 WeakPolarHBondContact CA-O 3.27Å; R404-S429 VanDerWaalsContact CG-O 3.29Å; R404-S429 WeakPolarHBondContact CG-O 3.28Å; R404-P431 VanDerWaalsContact O-CG 3.3Å; R404-P431 WeakPolarHBondContact O-CG 3.26Å
405	S	95.4	Very high	93.3	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-66	-20.6	-178.7	-64.6	0	0	0	0	113.4	C382 E401 C402 A403 G407 R408	C382-S405 VanDerWaalsContact CB-O 3.28Å; C382-S405 WeakPolarHBondContact CB-O 3.41Å; E401-S405 PolarHBondContact O-N 3.47Å; E401-S405 PolarHBondContact O-OG 3.33Å; C402-S405 VanDerWaalsContact O-CB 3.31Å; C402-S405 WeakPolarHBondContact O-CB 3.5Å; C402-S405 PolarHBondContact O-N 2.87Å; A403-S405 VanDerWaalsContact C-N 3.28Å; A403-S405 PolarHBondContact O-N 3.34Å; S405-G407 PolarHBondContact O-N 2.91Å; S405-G407 VanDerWaalsContact O-N 3.08Å; S405-R408 WeakPolarHBondContact O-CB 3.09Å; S405-R408 PolarHBondContact O-N 2.97Å
406	L	96.2	Very high	93.8	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-57.8	-24.1	175	-62.4	-179.3	0	0	0	113	F378 L391 F393 A403 R404 R408 L409 L415 I430 V434	F378-L406 HydrophobicContact CE1-CD2 4Å; F378-L406 HydrophobicContact CZ-CD2 3.77Å; L391-L406 HydrophobicContact CD2-CD2 3.45Å; L391-L406 VanDerWaalsContact CD2-CD2 3.45Å; F393-L406 HydrophobicContact CE2-CD2 4.19Å; A403-L406 WeakPolarHBondContact O-CB 3.47Å; A403-L406 WeakPolarHBondContact O-CG 2.94Å; A403-L406 PolarHBondContact O-N 3.35Å; R404-L406 PolarHBondContact O-N 3.13Å; L406-R408 PolarHBondContact O-N 3.03Å; L406-L409 HydrophobicContact CD2-CD1 3.87Å; L406-L409 WeakPolarHBondContact O-CB 3.45Å; L406-L409 PolarHBondContact O-N 2.93Å; L406-L415 HydrophobicContact CD1-CD1 4.46Å; L406-L415 HydrophobicContact CD1-CD2 4.21Å; L406-I430 HydrophobicContact CD1-CD1 3.89Å; L406-I430 HydrophobicContact CD1-CG1 4.07Å; L406-I430 HydrophobicContact CD1-CG2 4.39Å; L406-V434 HydrophobicContact CB-CG2 4.08Å; L406-V434 WeakPolarHBondContact O-CG2 3.41Å
407	G	96.1	Very high	93.9	Very high	27 Å²	27	51.3 Å²	51.3	28%	0.278	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-58.4	-18	174.1	0	0	0	0	0	114.6	R404 S405	R404-G407 PolarHBondContact O-N 3.33Å; S405-G407 PolarHBondContact O-N 2.91Å; S405-G407 VanDerWaalsContact O-N 3.08Å
408	R	95.7	Very high	93.7	Very high	110 Å²	110	45.7 Å²	45.7	42%	0.415	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-80.1	-19.8	176	-58.9	-175.1	-179.3	-177.4	7.9	112.9	E379 C382 T383 S405 L406 K410	E379-R408 VanDerWaalsContact CG-NH1 3.33Å; E379-R408 IonicContact OE1-CZ 3.11Å; E379-R408 IonicContact OE1-NH1 2.84Å; E379-R408 PolarHBondContact OE1-NH1 2.9Å; E379-R408 IonicContact OE1-NH2 2.65Å; E379-R408 PolarHBondContact OE1-NH2 2.96Å; C382-R408 HydrophobicContact CB-CB 4.07Å; C382-R408 VanDerWaalsContact O-CB 3.29Å; C382-R408 WeakPolarHBondContact O-CB 3.36Å; T383-R408 WeakPolarHBondContact OG1-CD 3.3Å; T383-R408 PolarHBondContact OG1-NH1 3.46Å; S405-R408 WeakPolarHBondContact O-CB 3.09Å; S405-R408 PolarHBondContact O-N 2.97Å; L406-R408 PolarHBondContact O-N 3.03Å; R408-K410 VanDerWaalsContact C-N 3.3Å; R408-K410 PolarHBondContact O-N 3.3Å
409	L	96.6	Very high	92.9	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	23%	0.225	C	C	.	.			trans	-82.9	71.7	179.1	-59	176.1	0	0	0	110.9	C382 A385 L388 L391 L406 K411 L412	C382-L409 HydrophobicContact CB-CD2 4.26Å; C382-L409 HydrophobicContact CB-CG 4.19Å; A385-L409 HydrophobicContact CB-CD2 4.01Å; A385-L409 WeakPolarHBondContact O-CD2 3.47Å; L388-L409 HydrophobicContact CB-CD2 4.22Å; L388-L409 HydrophobicContact CD2-CD1 4.11Å; L388-L409 HydrophobicContact CD2-CD2 4.39Å; L391-L409 HydrophobicContact CD2-CD1 3.68Å; L406-L409 HydrophobicContact CD2-CD1 3.87Å; L406-L409 WeakPolarHBondContact O-CB 3.45Å; L406-L409 PolarHBondContact O-N 2.93Å; L409-K411 PolarHBondContact O-N 2.93Å; L409-L412 HydrophobicContact CB-CB 3.9Å; L409-L412 HydrophobicContact CD1-CD2 4.3Å; L409-L412 VanDerWaalsContact O-CB 3.31Å; L409-L412 WeakPolarHBondContact O-CB 3.2Å; L409-L412 PolarHBondContact O-N 3.42Å
410	K	96	Very high	91.7	Very high	171 Å²	171	46.5 Å²	46.5	74%	0.743	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.8	-174	-63.2	-178.8	-178.6	179.3	0	114.7	R408	R408-K410 VanDerWaalsContact C-N 3.3Å; R408-K410 PolarHBondContact O-N 3.3Å
411	K	97.4	Very high	90.5	Very high	116 Å²	116	46.3 Å²	46.3	50%	0.504	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	2.8	179.4	-63.5	-164.5	-173.9	-178.5	0	113.9	L388 E389 L409 T413	L388-K411 CarbonylContact O-C 3.55Å; L388-K411 VanDerWaalsContact O-C 3.22Å; E389-K411 WeakPolarHBondContact CA-O 3.45Å; L409-K411 PolarHBondContact O-N 2.93Å; K411-T413 PolarHBondContact O-N 3.46Å; K411-T413 VanDerWaalsContact O-N 3.16Å
412	L	98.1	Very high	89.9	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.198	C	C	.	.			trans	-64.2	119.6	-179.4	-168.8	69.4	0	0	0	109.9	L388 L391 L409 T414 L415 V434 L438	L388-L412 PolarHBondContact O-N 2.91Å; L391-L412 HydrophobicContact CB-CD1 3.57Å; L409-L412 HydrophobicContact CB-CB 3.9Å; L409-L412 HydrophobicContact CD1-CD2 4.3Å; L409-L412 VanDerWaalsContact O-CB 3.31Å; L409-L412 WeakPolarHBondContact O-CB 3.2Å; L409-L412 PolarHBondContact O-N 3.42Å; L412-T414 WeakPolarHBondContact CD1-O 3.26Å; L412-L415 HydrophobicContact CD2-CB 4.41Å; L412-L415 HydrophobicContact CD2-CD1 4.44Å; L412-V434 HydrophobicContact CD2-CG1 3.92Å; L412-L438 HydrophobicContact CD2-CD2 4.41Å; L412-L438 HydrophobicContact CG-CD2 4.18Å
413	T	97.9	Very high	89.8	Confident	41 Å²	41	46.3 Å²	46.3	25%	0.252	21%	0.211	S	C	.	.			trans	-117.3	-24.1	180	57.7	0	0	0	0	112.2	E389 K411 L438 L439 H440	E389-T413 PolarHBondContact O-N 3.07Å; E389-T413 PolarHBondContact O-OG1 3.16Å; E389-T413 VanDerWaalsContact O-OG1 3.09Å; K411-T413 PolarHBondContact O-N 3.46Å; K411-T413 VanDerWaalsContact O-N 3.16Å; T413-L438 CarbonylContact O-C 3.6Å; T413-L438 WeakPolarHBondContact O-CA 3.36Å; T413-L439 HydrophobicContact CG2-CD1 4.19Å; T413-L439 HydrophobicContact CG2-CG 4.32Å; T413-L439 PolarHBondContact O-N 3.04Å; T413-H440 PolarHBondContact O-N 3.4Å
414	T	97.8	Very high	89.5	Confident	22 Å²	22	47.9 Å²	47.9	14%	0.135	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126	175.8	-57.8	0	0	0	0	109.8	E389 V390 L391 L412 R416 H440	E389-T414 PolarHBondContact O-N 2.87Å; V390-T414 WeakPolarHBondContact CA-O 3.43Å; V390-T414 HydrophobicContact CG1-CG2 3.85Å; L391-T414 PolarHBondContact N-O 2.96Å; L412-T414 WeakPolarHBondContact CD1-O 3.26Å; T414-R416 HydrophobicContact CG2-CG 4.08Å; T414-H440 WeakPolarHBondContact CA-O 3.37Å; T414-H440 HydrophobicContact CG2-CB 3.99Å
415	L	96.1	Very high	89.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.2	173.6	179.1	60	0	0	0	108.6	L391 F393 L406 L412 I417 I430 L438 H440 L441 E442	L391-L415 HydrophobicContact CB-CD1 4.38Å; L391-L415 HydrophobicContact CD2-CD1 4.5Å; L391-L415 HydrophobicContact CG-CD1 4.47Å; L391-L415 WeakPolarHBondContact O-CA 3.3Å; F393-L415 HydrophobicContact CD2-CD1 4.23Å; F393-L415 HydrophobicContact CE2-CD1 4.34Å; L406-L415 HydrophobicContact CD1-CD1 4.46Å; L406-L415 HydrophobicContact CD1-CD2 4.21Å; L412-L415 HydrophobicContact CD2-CB 4.41Å; L412-L415 HydrophobicContact CD2-CD1 4.44Å; L415-I417 HydrophobicContact CD1-CD1 4.27Å; L415-I417 HydrophobicContact CD1-CG1 4.1Å; L415-I417 HydrophobicContact CD2-CD1 3.81Å; L415-I417 HydrophobicContact CD2-CG1 4.49Å; L415-I417 HydrophobicContact CG-CD1 3.83Å; L415-I417 HydrophobicContact CG-CG1 3.98Å; L415-I430 HydrophobicContact CD2-CD1 3.78Å; L415-L438 HydrophobicContact CB-CD1 3.93Å; L415-L438 HydrophobicContact CB-CD2 3.88Å; L415-L438 HydrophobicContact CD2-CD1 4.4Å; L415-H440 PolarHBondContact N-O 2.79Å; L415-H440 VanDerWaalsContact N-O 3.1Å; L415-L441 HydrophobicContact CB-CD1 4.24Å; L415-L441 HydrophobicContact CD2-CD1 4.32Å; L415-L441 HydrophobicContact CG-CD1 4.33Å; L415-E442 PolarHBondContact O-N 3.2Å
416	R	94.3	Very high	89.1	Confident	81 Å²	81	45.6 Å²	45.6	31%	0.306	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.4	175.8	-56.5	-176.7	158.2	162	-1.6	109.9	L391 D392 F393 T414 E442	L391-R416 PolarHBondContact O-N 3.22Å; D392-R416 HydrophobicContact CB-CB 3.99Å; D392-R416 HydrophobicContact CB-CG 4.5Å; D392-R416 WeakPolarHBondContact OD2-CD 3.4Å; D392-R416 IonicContact OD2-NH1 3.45Å; F393-R416 PolarHBondContact N-O 2.94Å; T414-R416 HydrophobicContact CG2-CG 4.08Å; R416-E442 WeakPolarHBondContact CA-O 3.48Å; R416-E442 HydrophobicContact CB-CB 4.32Å; R416-E442 WeakPolarHBondContact CD-OE2 3.45Å; R416-E442 HydrophobicContact CG-CB 3.92Å; R416-E442 IonicContact CZ-OE2 3.54Å; R416-E442 IonicContact NE-OE2 3.46Å; R416-E442 PolarHBondContact NE-OE2 3.3Å; R416-E442 IonicContact NH2-OE2 2.74Å
417	I	88.8	Confident	88.9	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.015	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	102.9	-176.8	-60.2	166.9	0	0	0	107.5	L415 N420 M422 L427 I430 E442 I443 H444	L415-I417 HydrophobicContact CD1-CD1 4.27Å; L415-I417 HydrophobicContact CD1-CG1 4.1Å; L415-I417 HydrophobicContact CD2-CD1 3.81Å; L415-I417 HydrophobicContact CD2-CG1 4.49Å; L415-I417 HydrophobicContact CG-CD1 3.83Å; L415-I417 HydrophobicContact CG-CG1 3.98Å; I417-N420 HydrophobicContact CG2-CB 4.31Å; I417-N420 WeakPolarHBondContact CG2-ND2 3.42Å; I417-M422 HydrophobicContact CB-CE 4.29Å; I417-M422 HydrophobicContact CD1-CE 3.85Å; I417-M422 HydrophobicContact CD1-SD 3.98Å; I417-M422 HydrophobicContact CG1-CE 4.18Å; I417-M422 HydrophobicContact CG2-CE 3.16Å; I417-M422 HydrophobicContact CG2-SD 3.58Å; I417-M422 VanDerWaalsContact CG2-SD 3.58Å; I417-L427 HydrophobicContact CD1-CD1 4.31Å; I417-I430 HydrophobicContact CD1-CD1 4.3Å; I417-E442 PolarHBondContact N-O 2.7Å; I417-I443 CarbonylContact O-C 3.55Å; I417-I443 VanDerWaalsContact O-CA 3.24Å; I417-I443 WeakPolarHBondContact O-CA 3.28Å; I417-H444 PolarHBondContact O-N 3.07Å
418	G	79.9	Confident	88.7	Confident	0 Å²	0	49 Å²	49	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.7	-178.1	0	0	0	0	0	114.3	D394 H395 N420 H444	D394-G418 CarbonylContact C-O 3.22Å; D394-G418 WeakPolarHBondContact CA-O 3.27Å; D394-G418 WeakPolarHBondContact OD1-CA 3.22Å; D394-G418 PolarHBondContact OD1-N 3.07Å; H395-G418 PolarHBondContact N-O 3.01Å; G418-N420 PolarHBondContact O-N 3.07Å; G418-N420 PolarHBondContact O-ND2 3.42Å; G418-N420 PolarHBondContact O-OD1 3.34Å; G418-H444 CarbonylContact C-O 3.56Å; G418-H444 VanDerWaalsContact CA-O 3.23Å; G418-H444 WeakPolarHBondContact CA-O 3.47Å
419	W	72.1	Confident	88.7	Confident	116 Å²	116	44.7 Å²	44.7	44%	0.439	21%	0.209	S	C	.	.	S	Bend	trans	55.2	24.4	169.7	-63.8	86.3	0	0	0	114.6	H395 H444 D445 L472	H395-W419 WeakPolarHBondContact CE1-CB 3.32Å; H395-W419 AromaticContact CE1-CD1 3.49Å; H395-W419 VanDerWaalsContact CE1-CD1 3.49Å; H395-W419 AromaticContact CE1-CD2 3.47Å; H395-W419 VanDerWaalsContact CE1-CD2 3.47Å; H395-W419 AromaticContact CE1-CE2 3.99Å; H395-W419 AromaticContact CE1-CG 3.16Å; H395-W419 AromaticContact CE1-NE1 3.98Å; H395-W419 WeakPolarHBondContact ND1-CB 3.42Å; H395-W419 AromaticContact ND1-CG 3.56Å; H395-W419 AromaticContact NE2-CD1 3.62Å; H395-W419 AromaticContact NE2-CG 3.75Å; W419-H444 PolarHBondContact N-O 2.94Å; W419-D445 HydrophobicContact CD2-CB 4.01Å; W419-D445 HydrophobicContact CE3-CB 4.4Å; W419-D445 VanDerWaalsContact CE3-OD2 3.23Å; W419-D445 HydrophobicContact CG-CB 4.26Å; W419-D445 VanDerWaalsContact CZ3-OD2 3.29Å; W419-D445 WeakPolarHBondContact CZ3-OD2 3.45Å; W419-L472 HydrophobicContact CH2-CD1 3.94Å; W419-L472 HydrophobicContact CZ2-CD1 3.91Å
420	N	64.1	Low	88.7	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.027	21%	0.209	C	C	.	.			trans	-95.8	140.7	-178.2	-67.3	-26.6	0	0	0	107.3	F393 H395 V396 I417 G418 M422	F393-N420 PolarHBondContact O-ND2 2.9Å; F393-N420 PolarHBondContact O-OD1 2.84Å; H395-N420 VanDerWaalsContact C-OD1 3.3Å; H395-N420 WeakPolarHBondContact CA-OD1 3.46Å; H395-N420 PolarHBondContact N-OD1 3.29Å; V396-N420 WeakPolarHBondContact CA-OD1 3.36Å; V396-N420 PolarHBondContact N-OD1 3Å; V396-N420 PolarHBondContact O-ND2 2.99Å; V396-N420 PolarHBondContact O-OD1 2.9Å; I417-N420 HydrophobicContact CG2-CB 4.31Å; I417-N420 WeakPolarHBondContact CG2-ND2 3.42Å; G418-N420 PolarHBondContact O-N 3.07Å; G418-N420 PolarHBondContact O-ND2 3.42Å; G418-N420 PolarHBondContact O-OD1 3.34Å; N420-M422 HydrophobicContact CB-CB 3.97Å; N420-M422 PolarHBondContact O-N 3.37Å
421	T	66.8	Low	88.7	Confident	62 Å²	62	38.1 Å²	38.1	38%	0.38	18%	0.184	S	C	.	.			trans	-68.9	39.7	164	64.2	0	0	0	0	110.6	R397 E423	R397-T421 WeakPolarHBondContact CD-OG1 3.46Å; R397-T421 WeakPolarHBondContact CG-OG1 3.34Å; R397-T421 PolarHBondContact NE-OG1 3.42Å; T421-E423 PolarHBondContact O-N 3.32Å
422	M	79.6	Confident	88.6	Confident	5 Å²	5	36 Å²	36	3%	0.025	18%	0.181	C	C	.	.			trans	-68.4	120	-173.9	-171.7	169.6	-73.7	0	0	108.8	V398 I417 N420 V426 L427 K448 I449	V398-M422 HydrophobicContact CB-CE 3.98Å; V398-M422 HydrophobicContact CG2-CE 4.08Å; I417-M422 HydrophobicContact CB-CE 4.29Å; I417-M422 HydrophobicContact CD1-CE 3.85Å; I417-M422 HydrophobicContact CD1-SD 3.98Å; I417-M422 HydrophobicContact CG1-CE 4.18Å; I417-M422 HydrophobicContact CG2-CE 3.16Å; I417-M422 HydrophobicContact CG2-SD 3.58Å; I417-M422 VanDerWaalsContact CG2-SD 3.58Å; N420-M422 HydrophobicContact CB-CB 3.97Å; N420-M422 PolarHBondContact O-N 3.37Å; M422-V426 HydrophobicContact CE-CG1 3.89Å; M422-V426 HydrophobicContact CG-CB 3.83Å; M422-V426 HydrophobicContact CG-CG1 3.94Å; M422-V426 HydrophobicContact SD-CG1 4.16Å; M422-L427 HydrophobicContact SD-CB 4.34Å; M422-L427 HydrophobicContact SD-CD1 4.06Å; M422-K448 WeakPolarHBondContact O-CB 3.44Å; M422-I449 HydrophobicContact CB-CD1 4.45Å; M422-I449 HydrophobicContact CG-CD1 4.44Å
423	E	87.1	Confident	88.5	Confident	58 Å²	58	40.7 Å²	40.7	27%	0.271	21%	0.206	S	C	.	.			trans	-89.9	155.3	177.5	-74.5	157.4	-169	0	0	109.5	T421 E425 V426 L427 K448	T421-E423 PolarHBondContact O-N 3.32Å; E423-E425 PolarHBondContact O-N 3.16Å; E423-V426 WeakPolarHBondContact O-CB 3.45Å; E423-V426 PolarHBondContact O-N 3.17Å; E423-L427 PolarHBondContact O-N 2.94Å; E423-K448 HydrophobicContact CG-CB 4.44Å; E423-K448 HydrophobicContact CG-CD 3.64Å; E423-K448 IonicContact OE1-NZ 2.99Å; E423-K448 PolarHBondContact OE1-NZ 3.38Å
424	N	88.9	Confident	88.5	Confident	34 Å²	34	38.9 Å²	38.9	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-44.9	-41.1	175.5	-70.2	-26.2	0	0	0	112.6	V426 L427 Q428 K448 I449 T450 C453	N424-V426 VanDerWaalsContact C-N 3.3Å; N424-V426 PolarHBondContact O-N 3.08Å; N424-L427 PolarHBondContact O-N 3.33Å; N424-Q428 WeakPolarHBondContact O-CB 3.48Å; N424-Q428 VanDerWaalsContact O-CG 3.24Å; N424-Q428 WeakPolarHBondContact O-CG 3.32Å; N424-Q428 PolarHBondContact O-N 3.41Å; N424-K448 PolarHBondContact OD1-O 3.01Å; N424-I449 VanDerWaalsContact OD1-CA 3.32Å; N424-I449 WeakPolarHBondContact OD1-CA 3.31Å; N424-T450 VanDerWaalsContact ND2-CG2 3.32Å; N424-T450 WeakPolarHBondContact ND2-CG2 3.29Å; N424-T450 PolarHBondContact ND2-OG1 2.77Å; N424-T450 PolarHBondContact OD1-N 3.18Å; N424-T450 PolarHBondContact OD1-OG1 3.25Å; N424-C453 HydrophobicContact CB-CB 4.02Å; N424-C453 PolarHBondContact O-SG 2.77Å; N424-C453 WeakPolarHBondContact OD1-CB 3.45Å
425	E	90.2	Very high	88.4	Confident	92 Å²	92	38 Å²	38	43%	0.43	19%	0.189	S	C	.	.	H	α-helix	trans	-67.6	-28.9	-176.1	-60.5	145.4	-163.5	0	0	112.8	K400 E423 S429	K400-E425 HydrophobicContact CD-CB 4.02Å; K400-E425 WeakPolarHBondContact CE-OE2 3.43Å; K400-E425 VanDerWaalsContact NZ-CB 3.33Å; K400-E425 IonicContact NZ-OE2 2.64Å; K400-E425 PolarHBondContact NZ-OE2 3.3Å; E423-E425 PolarHBondContact O-N 3.16Å; E425-S429 VanDerWaalsContact O-CB 3.3Å; E425-S429 WeakPolarHBondContact O-CB 3.44Å; E425-S429 PolarHBondContact O-N 3.11Å; E425-S429 PolarHBondContact O-OG 3.26Å
426	V	90.9	Very high	88.4	Confident	8 Å²	8	39.6 Å²	39.6	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-72	-46.6	175.2	178.4	0	0	0	0	109.5	V398 K400 A403 M422 E423 N424 Q428 S429 I430	V398-V426 HydrophobicContact CB-CG1 4.18Å; V398-V426 HydrophobicContact CG1-CG1 4.18Å; V398-V426 WeakPolarHBondContact O-CG1 3.33Å; V398-V426 WeakPolarHBondContact O-CG2 3.32Å; K400-V426 HydrophobicContact CG-CG2 4.01Å; A403-V426 HydrophobicContact CB-CG1 3.93Å; A403-V426 WeakPolarHBondContact CB-O 3.37Å; M422-V426 HydrophobicContact CE-CG1 3.89Å; M422-V426 HydrophobicContact CG-CB 3.83Å; M422-V426 HydrophobicContact CG-CG1 3.94Å; M422-V426 HydrophobicContact SD-CG1 4.16Å; E423-V426 WeakPolarHBondContact O-CB 3.45Å; E423-V426 PolarHBondContact O-N 3.17Å; N424-V426 VanDerWaalsContact C-N 3.3Å; N424-V426 PolarHBondContact O-N 3.08Å; V426-Q428 VanDerWaalsContact C-N 3.34Å; V426-Q428 PolarHBondContact O-N 3.35Å; V426-S429 WeakPolarHBondContact O-CB 3.36Å; V426-S429 PolarHBondContact O-N 3.16Å; V426-I430 PolarHBondContact O-N 3.36Å
427	L	92.1	Very high	88.5	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-41.3	177.9	-164.2	70.1	0	0	0	111	I417 M422 E423 N424 S429 I430 Y435 I443 I449 L454 V457	I417-L427 HydrophobicContact CD1-CD1 4.31Å; M422-L427 HydrophobicContact SD-CB 4.34Å; M422-L427 HydrophobicContact SD-CD1 4.06Å; E423-L427 PolarHBondContact O-N 2.94Å; N424-L427 PolarHBondContact O-N 3.33Å; L427-S429 PolarHBondContact O-N 3.4Å; L427-I430 HydrophobicContact CD1-CD1 4.18Å; L427-I430 WeakPolarHBondContact O-CB 3.47Å; L427-I430 PolarHBondContact O-N 3.48Å; L427-Y435 VanDerWaalsContact CD1-OH 3.31Å; L427-Y435 WeakPolarHBondContact CD1-OH 3.38Å; L427-Y435 VanDerWaalsContact CG-OH 3.31Å; L427-Y435 WeakPolarHBondContact CG-OH 3.28Å; L427-Y435 PolarHBondContact O-OH 2.97Å; L427-I443 HydrophobicContact CD2-CD1 4.37Å; L427-I449 HydrophobicContact CD2-CD1 4.24Å; L427-I449 HydrophobicContact CD2-CG2 4.18Å; L427-L454 HydrophobicContact CD2-CD2 4.31Å; L427-V457 HydrophobicContact CD2-CG2 3.7Å; L427-V457 HydrophobicContact CG-CG2 3.76Å
428	Q	93.1	Very high	88.9	Confident	102 Å²	102	37.9 Å²	37.9	48%	0.477	20%	0.199	S	C	.	.	H	α-helix	trans	-68.3	-20.2	174.1	-70.3	173.1	22	0	0	113.7	N424 V426 I430	N424-Q428 WeakPolarHBondContact O-CB 3.48Å; N424-Q428 VanDerWaalsContact O-CG 3.24Å; N424-Q428 WeakPolarHBondContact O-CG 3.32Å; N424-Q428 PolarHBondContact O-N 3.41Å; V426-Q428 VanDerWaalsContact C-N 3.34Å; V426-Q428 PolarHBondContact O-N 3.35Å; Q428-I430 VanDerWaalsContact C-N 3.3Å
429	S	95	Very high	89.7	Confident	19 Å²	19	42.2 Å²	42.2	13%	0.133	22%	0.222	C	C	.	.	H	α-helix	trans	-79.8	-12.3	176.5	-65.7	0	0	0	0	113.1	K400 R404 E425 V426 L427 P431	K400-S429 WeakPolarHBondContact O-CB 3.34Å; R404-S429 WeakPolarHBondContact CA-O 3.27Å; R404-S429 VanDerWaalsContact CG-O 3.29Å; R404-S429 WeakPolarHBondContact CG-O 3.28Å; E425-S429 VanDerWaalsContact O-CB 3.3Å; E425-S429 WeakPolarHBondContact O-CB 3.44Å; E425-S429 PolarHBondContact O-N 3.11Å; E425-S429 PolarHBondContact O-OG 3.26Å; V426-S429 WeakPolarHBondContact O-CB 3.36Å; V426-S429 PolarHBondContact O-N 3.16Å; L427-S429 PolarHBondContact O-N 3.4Å; S429-P431 WeakPolarHBondContact O-CD 3.37Å
430	I	95.9	Very high	90.9	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	21%	0.207	C	C	.	.	S	Bend	trans	-67.7	125.2	172.1	-59.5	-174.5	0	0	0	108.5	A403 L406 L415 I417 V426 L427 Q428 V434 Y435	A403-I430 HydrophobicContact CB-CG1 3.87Å; L406-I430 HydrophobicContact CD1-CD1 3.89Å; L406-I430 HydrophobicContact CD1-CG1 4.07Å; L406-I430 HydrophobicContact CD1-CG2 4.39Å; L415-I430 HydrophobicContact CD2-CD1 3.78Å; I417-I430 HydrophobicContact CD1-CD1 4.3Å; V426-I430 PolarHBondContact O-N 3.36Å; L427-I430 HydrophobicContact CD1-CD1 4.18Å; L427-I430 WeakPolarHBondContact O-CB 3.47Å; L427-I430 PolarHBondContact O-N 3.48Å; Q428-I430 VanDerWaalsContact C-N 3.3Å; I430-V434 HydrophobicContact CG2-CB 3.71Å; I430-V434 HydrophobicContact CG2-CG1 3.91Å; I430-V434 HydrophobicContact CG2-CG2 4.1Å; I430-Y435 HydrophobicContact CB-CE1 4.48Å; I430-Y435 HydrophobicContact CB-CE2 3.66Å; I430-Y435 WeakPolarHBondContact CB-OH 3.37Å; I430-Y435 HydrophobicContact CD1-CE1 4.46Å; I430-Y435 WeakPolarHBondContact CD1-OH 3.47Å; I430-Y435 HydrophobicContact CG2-CD2 4.26Å; I430-Y435 HydrophobicContact CG2-CE1 4.21Å; I430-Y435 HydrophobicContact CG2-CE2 3.76Å; I430-Y435 WeakPolarHBondContact O-CE2 3.48Å
431	P	96.6	Very high	92.3	Very high	32 Å²	32	38 Å²	38	21%	0.208	21%	0.207	C	C	.	.			trans	-60.1	138.6	-177.4	-27.2	37.7	0	0	0	111.9	A403 R404 S429 I433 V434	A403-P431 WeakPolarHBondContact O-CD 3.49Å; R404-P431 VanDerWaalsContact O-CG 3.3Å; R404-P431 WeakPolarHBondContact O-CG 3.26Å; S429-P431 WeakPolarHBondContact O-CD 3.37Å; P431-I433 HydrophobicContact CB-CG2 4Å; P431-I433 PolarHBondContact O-N 3.49Å; P431-V434 HydrophobicContact CB-CG2 4.32Å; P431-V434 WeakPolarHBondContact O-CB 3Å; P431-V434 PolarHBondContact O-N 2.86Å
432	P	96.3	Very high	93.5	Very high	70 Å²	70	36.4 Å²	36.4	46%	0.455	20%	0.195	S	C	.	.	H	α-helix	trans	-51.9	-31.8	179.9	-31.8	37	0	0	0	114.9	V434 Y435 A436 H460	P432-V434 PolarHBondContact O-N 3.49Å; P432-Y435 PolarHBondContact O-N 3.23Å; P432-A436 PolarHBondContact O-N 3.04Å; P432-H460 HydrophobicContact CB-CB 4.39Å
433	I	95.9	Very high	94	Very high	101 Å²	101	36.2 Å²	36.2	52%	0.518	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-29.9	177.4	-169.5	61.3	0	0	0	113	P431 N437	P431-I433 HydrophobicContact CB-CG2 4Å; P431-I433 PolarHBondContact O-N 3.49Å; I433-N437 VanDerWaalsContact O-CG 3.31Å; I433-N437 PolarHBondContact O-N 2.99Å; I433-N437 PolarHBondContact O-ND2 2.96Å
434	V	96.5	Very high	93.8	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.018	19%	0.187	C	C	.	.	H	α-helix	trans	-66.9	-52	175.7	-179.3	0	0	0	0	109	L406 L412 I430 P431 P432 A436 N437 L438	L406-V434 HydrophobicContact CB-CG2 4.08Å; L406-V434 WeakPolarHBondContact O-CG2 3.41Å; L412-V434 HydrophobicContact CD2-CG1 3.92Å; I430-V434 HydrophobicContact CG2-CB 3.71Å; I430-V434 HydrophobicContact CG2-CG1 3.91Å; I430-V434 HydrophobicContact CG2-CG2 4.1Å; P431-V434 HydrophobicContact CB-CG2 4.32Å; P431-V434 WeakPolarHBondContact O-CB 3Å; P431-V434 PolarHBondContact O-N 2.86Å; P432-V434 PolarHBondContact O-N 3.49Å; V434-A436 VanDerWaalsContact C-N 3.27Å; V434-A436 PolarHBondContact O-N 2.79Å; V434-N437 WeakPolarHBondContact O-CA 3.31Å; V434-N437 WeakPolarHBondContact O-CB 2.9Å; V434-N437 PolarHBondContact O-N 3.05Å; V434-L438 WeakPolarHBondContact O-CG 3.14Å; V434-L438 PolarHBondContact O-N 3.24Å; V434-L438 VanDerWaalsContact O-N 3.16Å
435	Y	96.4	Very high	93.5	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-56.8	-40.4	177.2	-68	-55.4	0	0	0	112.9	L427 I430 P432 N437 L438 L441 V457 H460 L461	L427-Y435 VanDerWaalsContact CD1-OH 3.31Å; L427-Y435 WeakPolarHBondContact CD1-OH 3.38Å; L427-Y435 VanDerWaalsContact CG-OH 3.31Å; L427-Y435 WeakPolarHBondContact CG-OH 3.28Å; L427-Y435 PolarHBondContact O-OH 2.97Å; I430-Y435 HydrophobicContact CB-CE1 4.48Å; I430-Y435 HydrophobicContact CB-CE2 3.66Å; I430-Y435 WeakPolarHBondContact CB-OH 3.37Å; I430-Y435 HydrophobicContact CD1-CE1 4.46Å; I430-Y435 WeakPolarHBondContact CD1-OH 3.47Å; I430-Y435 HydrophobicContact CG2-CD2 4.26Å; I430-Y435 HydrophobicContact CG2-CE1 4.21Å; I430-Y435 HydrophobicContact CG2-CE2 3.76Å; I430-Y435 WeakPolarHBondContact O-CE2 3.48Å; P432-Y435 PolarHBondContact O-N 3.23Å; Y435-N437 PolarHBondContact O-N 2.74Å; Y435-L438 HydrophobicContact CD1-CD1 4.06Å; Y435-L438 PolarHBondContact O-N 3.16Å; Y435-L441 HydrophobicContact CE1-CD2 4.38Å; Y435-V457 HydrophobicContact CD1-CG1 3.69Å; Y435-V457 HydrophobicContact CD2-CG1 4.38Å; Y435-V457 HydrophobicContact CE1-CG1 3.34Å; Y435-V457 HydrophobicContact CE2-CG1 4.08Å; Y435-V457 HydrophobicContact CE2-CG2 4.26Å; Y435-V457 HydrophobicContact CG-CG1 4.2Å; Y435-H460 CarbonylContact C-O 3.54Å; Y435-H460 VanDerWaalsContact C-O 3.25Å; Y435-H460 HydrophobicContact CD2-CB 4.14Å; Y435-H460 HydrophobicContact CG-CB 4.23Å; Y435-L461 HydrophobicContact CD1-CD2 3.82Å; Y435-L461 HydrophobicContact CG-CD2 4.3Å
436	A	95.9	Very high	93.1	Very high	34 Å²	34	30.5 Å²	30.5	28%	0.281	17%	0.167	S	C	.	.	H	α-helix	trans	-65.3	-18.9	176.9	0	0	0	0	0	113	P432 V434 H460 K462	P432-A436 PolarHBondContact O-N 3.04Å; V434-A436 VanDerWaalsContact C-N 3.27Å; V434-A436 PolarHBondContact O-N 2.79Å; A436-H460 VanDerWaalsContact CA-O 3.26Å; A436-H460 WeakPolarHBondContact CA-O 3.46Å; A436-H460 PolarHBondContact N-O 2.97Å; A436-H460 VanDerWaalsContact N-O 3.08Å; A436-K462 WeakPolarHBondContact O-CD 3.45Å; A436-K462 WeakPolarHBondContact O-CE 3.43Å; A436-K462 VanDerWaalsContact O-CG 3.32Å; A436-K462 WeakPolarHBondContact O-CG 3.47Å; A436-K462 PolarHBondContact O-NZ 2.65Å
437	N	96.7	Very high	92.6	Very high	48 Å²	48	34.9 Å²	34.9	26%	0.257	20%	0.196	S	C	.	.	H	α-helix	trans	-95.9	-18.5	177.5	-70.6	-21.6	0	0	0	113.6	I433 V434 Y435 L439	I433-N437 VanDerWaalsContact O-CG 3.31Å; I433-N437 PolarHBondContact O-N 2.99Å; I433-N437 PolarHBondContact O-ND2 2.96Å; V434-N437 WeakPolarHBondContact O-CA 3.31Å; V434-N437 WeakPolarHBondContact O-CB 2.9Å; V434-N437 PolarHBondContact O-N 3.05Å; Y435-N437 PolarHBondContact O-N 2.74Å; N437-L439 PolarHBondContact O-N 2.91Å
438	L	97.5	Very high	92.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.216	C	C	.	.			trans	-66.1	134.2	-178.7	-63.7	-177.3	0	0	0	112	L412 T413 L415 V434 Y435 L441 L461	L412-L438 HydrophobicContact CD2-CD2 4.41Å; L412-L438 HydrophobicContact CG-CD2 4.18Å; T413-L438 CarbonylContact O-C 3.6Å; T413-L438 WeakPolarHBondContact O-CA 3.36Å; L415-L438 HydrophobicContact CB-CD1 3.93Å; L415-L438 HydrophobicContact CB-CD2 3.88Å; L415-L438 HydrophobicContact CD2-CD1 4.4Å; V434-L438 WeakPolarHBondContact O-CG 3.14Å; V434-L438 PolarHBondContact O-N 3.24Å; V434-L438 VanDerWaalsContact O-N 3.16Å; Y435-L438 HydrophobicContact CD1-CD1 4.06Å; Y435-L438 PolarHBondContact O-N 3.16Å; L438-L441 HydrophobicContact CD1-CB 4.13Å; L438-L441 HydrophobicContact CD1-CD1 4.05Å; L438-L461 HydrophobicContact CB-CD2 4.43Å; L438-L461 HydrophobicContact CD1-CD2 4.41Å
439	L	96.8	Very high	91.8	Very high	90 Å²	90	35.3 Å²	35.3	47%	0.471	20%	0.197	S	C	.	.	S	Bend	trans	-98.5	-24.2	164.7	-57.9	-179.5	0	0	0	110.8	T413 N437 C465 R466	T413-L439 HydrophobicContact CG2-CD1 4.19Å; T413-L439 HydrophobicContact CG2-CG 4.32Å; T413-L439 PolarHBondContact O-N 3.04Å; N437-L439 PolarHBondContact O-N 2.91Å; L439-C465 WeakPolarHBondContact O-CA 3.32Å; L439-R466 PolarHBondContact O-N 3.22Å
440	H	96.2	Very high	91.4	Very high	30 Å²	30	37.8 Å²	37.8	14%	0.139	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	128.5	176.5	-167.5	50.7	0	0	0	111.4	T413 T414 L415 E442 R466 S468	T413-H440 PolarHBondContact O-N 3.4Å; T414-H440 WeakPolarHBondContact CA-O 3.37Å; T414-H440 HydrophobicContact CG2-CB 3.99Å; L415-H440 PolarHBondContact N-O 2.79Å; L415-H440 VanDerWaalsContact N-O 3.1Å; H440-E442 IonicContact NE2-OE2 2.77Å; H440-E442 PolarHBondContact NE2-OE2 2.99Å; H440-R466 WeakPolarHBondContact CA-O 3.39Å; H440-R466 PolarHBondContact ND1-O 2.91Å; H440-S468 PolarHBondContact CE1-OG 3.34Å
441	L	94.4	Very high	90.5	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	116.3	170.8	176.7	62.4	0	0	0	108.1	L415 Y435 L438 I443 V457 L461 R466 I467 S468	L415-L441 HydrophobicContact CB-CD1 4.24Å; L415-L441 HydrophobicContact CD2-CD1 4.32Å; L415-L441 HydrophobicContact CG-CD1 4.33Å; Y435-L441 HydrophobicContact CE1-CD2 4.38Å; L438-L441 HydrophobicContact CD1-CB 4.13Å; L438-L441 HydrophobicContact CD1-CD1 4.05Å; L441-I443 HydrophobicContact CD1-CG1 4.33Å; L441-I443 HydrophobicContact CD2-CD1 4.28Å; L441-I443 HydrophobicContact CG-CD1 4.36Å; L441-I443 HydrophobicContact CG-CG1 4.26Å; L441-V457 HydrophobicContact CD2-CG1 4.19Å; L441-L461 HydrophobicContact CD2-CD1 4.12Å; L441-L461 HydrophobicContact CD2-CD2 4.31Å; L441-R466 PolarHBondContact N-O 3.31Å; L441-I467 CarbonylContact O-C 3.33Å; L441-I467 WeakPolarHBondContact O-CA 3.48Å; L441-S468 PolarHBondContact O-N 3.39Å
442	E	92.4	Very high	90	Very high	28 Å²	28	41.9 Å²	41.9	13%	0.131	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.5	179.9	-160.6	170.3	-178.5	0	0	109.5	L415 R416 I417 H440 H444 S468	L415-E442 PolarHBondContact O-N 3.2Å; R416-E442 WeakPolarHBondContact CA-O 3.48Å; R416-E442 HydrophobicContact CB-CB 4.32Å; R416-E442 WeakPolarHBondContact CD-OE2 3.45Å; R416-E442 HydrophobicContact CG-CB 3.92Å; R416-E442 IonicContact CZ-OE2 3.54Å; R416-E442 IonicContact NE-OE2 3.46Å; R416-E442 PolarHBondContact NE-OE2 3.3Å; R416-E442 IonicContact NH2-OE2 2.74Å; I417-E442 PolarHBondContact N-O 2.7Å; H440-E442 IonicContact NE2-OE2 2.77Å; H440-E442 PolarHBondContact NE2-OE2 2.99Å; E442-H444 VanDerWaalsContact CG-NE2 3.34Å; E442-H444 WeakPolarHBondContact CG-NE2 3.42Å; E442-H444 IonicContact OE1-CE1 3.99Å; E442-H444 PolarHBondContact OE1-CE1 3.26Å; E442-H444 IonicContact OE1-NE2 2.68Å; E442-H444 PolarHBondContact OE1-NE2 3.12Å; E442-H444 IonicContact OE2-NE2 3.73Å; E442-S468 CarbonylContact C-O 3.47Å; E442-S468 WeakPolarHBondContact CA-O 3.48Å
443	I	88.9	Confident	89.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	111.8	179	-57.7	174.1	0	0	0	108.1	I417 L427 L441 A446 I449 L454 S468 F469 V470	I417-I443 CarbonylContact O-C 3.55Å; I417-I443 VanDerWaalsContact O-CA 3.24Å; I417-I443 WeakPolarHBondContact O-CA 3.28Å; L427-I443 HydrophobicContact CD2-CD1 4.37Å; L441-I443 HydrophobicContact CD1-CG1 4.33Å; L441-I443 HydrophobicContact CD2-CD1 4.28Å; L441-I443 HydrophobicContact CG-CD1 4.36Å; L441-I443 HydrophobicContact CG-CG1 4.26Å; I443-A446 HydrophobicContact CG2-CB 3.61Å; I443-I449 HydrophobicContact CG2-CD1 3.9Å; I443-L454 HydrophobicContact CD1-CD2 3.79Å; I443-S468 PolarHBondContact N-O 3.01Å; I443-F469 HydrophobicContact CB-CD2 3.86Å; I443-F469 HydrophobicContact CB-CE2 4.25Å; I443-F469 HydrophobicContact CG2-CD2 3.98Å; I443-F469 HydrophobicContact CG2-CE2 3.82Å; I443-F469 WeakPolarHBondContact O-CA 3.42Å; I443-V470 PolarHBondContact O-N 3.3Å
444	H	84.2	Confident	89.1	Confident	29 Å²	29	35.1 Å²	35.1	13%	0.134	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.1	176.1	-54.4	-84	0	0	0	111.2	D394 I417 G418 W419 E442 A446 V470	D394-H444 IonicContact OD1-CD2 3.81Å; D394-H444 IonicContact OD2-CD2 3.75Å; I417-H444 PolarHBondContact O-N 3.07Å; G418-H444 CarbonylContact C-O 3.56Å; G418-H444 VanDerWaalsContact CA-O 3.23Å; G418-H444 WeakPolarHBondContact CA-O 3.47Å; W419-H444 PolarHBondContact N-O 2.94Å; E442-H444 VanDerWaalsContact CG-NE2 3.34Å; E442-H444 WeakPolarHBondContact CG-NE2 3.42Å; E442-H444 IonicContact OE1-CE1 3.99Å; E442-H444 PolarHBondContact OE1-CE1 3.26Å; E442-H444 IonicContact OE1-NE2 2.68Å; E442-H444 PolarHBondContact OE1-NE2 3.12Å; E442-H444 IonicContact OE2-NE2 3.73Å; H444-A446 PolarHBondContact O-N 3.08Å; H444-A446 VanDerWaalsContact O-N 3.13Å; H444-V470 CarbonylContact C-O 3.49Å; H444-V470 WeakPolarHBondContact CA-O 3.31Å; H444-V470 VanDerWaalsContact ND1-CB 3.31Å; H444-V470 WeakPolarHBondContact ND1-CB 3.31Å
445	D	81.1	Confident	88.5	Confident	33 Å²	33	38.4 Å²	38.4	18%	0.176	22%	0.217	C	C	.	.	S	Bend	trans	38.4	58.6	168.8	-163.6	30.1	0	0	0	115	W419 P447 V470	W419-D445 HydrophobicContact CD2-CB 4.01Å; W419-D445 HydrophobicContact CE3-CB 4.4Å; W419-D445 VanDerWaalsContact CE3-OD2 3.23Å; W419-D445 HydrophobicContact CG-CB 4.26Å; W419-D445 VanDerWaalsContact CZ3-OD2 3.29Å; W419-D445 WeakPolarHBondContact CZ3-OD2 3.45Å; D445-P447 WeakPolarHBondContact O-CD 3.46Å; D445-V470 PolarHBondContact N-O 2.83Å
446	A	82.2	Confident	88	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.017	24%	0.235	C	C	.	.			trans	-111.6	73.4	-178	0	0	0	0	0	111.2	I443 H444 K448 I449	I443-A446 HydrophobicContact CG2-CB 3.61Å; H444-A446 PolarHBondContact O-N 3.08Å; H444-A446 VanDerWaalsContact O-N 3.13Å; A446-K448 PolarHBondContact O-N 2.92Å; A446-K448 VanDerWaalsContact O-N 3.07Å; A446-I449 HydrophobicContact CB-CB 4.36Å; A446-I449 HydrophobicContact CB-CD1 3.42Å; A446-I449 VanDerWaalsContact CB-CD1 3.42Å; A446-I449 HydrophobicContact CB-CG1 3.82Å; A446-I449 PolarHBondContact O-N 2.88Å; A446-I449 VanDerWaalsContact O-N 3.07Å
447	P	81.2	Confident	87.6	Confident	101 Å²	101	40.5 Å²	40.5	66%	0.656	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.3	-169.8	26.2	-36.5	0	0	0	114.3	D445	D445-P447 WeakPolarHBondContact O-CD 3.46Å
448	K	85.1	Confident	87.2	Confident	95 Å²	95	39.5 Å²	39.5	41%	0.413	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-8.5	178.7	-66.8	-175.4	175.2	-176.3	0	113.7	M422 E423 N424 A446 T450	M422-K448 WeakPolarHBondContact O-CB 3.44Å; E423-K448 HydrophobicContact CG-CB 4.44Å; E423-K448 HydrophobicContact CG-CD 3.64Å; E423-K448 IonicContact OE1-NZ 2.99Å; E423-K448 PolarHBondContact OE1-NZ 3.38Å; N424-K448 PolarHBondContact OD1-O 3.01Å; A446-K448 PolarHBondContact O-N 2.92Å; A446-K448 VanDerWaalsContact O-N 3.07Å; K448-T450 PolarHBondContact O-N 2.81Å
449	I	83.7	Confident	86.9	Confident	15 Å²	15	48.9 Å²	48.9	8%	0.077	26%	0.255	C	S	.	.			trans	-82.2	116.8	178.4	-61.4	179	0	0	0	108.6	M422 N424 L427 I443 A446 C453 L454	M422-I449 HydrophobicContact CB-CD1 4.45Å; M422-I449 HydrophobicContact CG-CD1 4.44Å; N424-I449 VanDerWaalsContact OD1-CA 3.32Å; N424-I449 WeakPolarHBondContact OD1-CA 3.31Å; L427-I449 HydrophobicContact CD2-CD1 4.24Å; L427-I449 HydrophobicContact CD2-CG2 4.18Å; I443-I449 HydrophobicContact CG2-CD1 3.9Å; A446-I449 HydrophobicContact CB-CB 4.36Å; A446-I449 HydrophobicContact CB-CD1 3.42Å; A446-I449 VanDerWaalsContact CB-CD1 3.42Å; A446-I449 HydrophobicContact CB-CG1 3.82Å; A446-I449 PolarHBondContact O-N 2.88Å; A446-I449 VanDerWaalsContact O-N 3.07Å; I449-C453 HydrophobicContact CG2-CB 4.3Å; I449-L454 HydrophobicContact CG2-CD2 3.84Å; I449-L454 HydrophobicContact CG2-CG 3.85Å
450	T	84.9	Confident	86.8	Confident	71 Å²	71	48.7 Å²	48.7	44%	0.436	25%	0.252	S	S	.	.			trans	-83.7	155.8	178	65.7	0	0	0	0	111.2	N424 K448 G452 C453 L454	N424-T450 VanDerWaalsContact ND2-CG2 3.32Å; N424-T450 WeakPolarHBondContact ND2-CG2 3.29Å; N424-T450 PolarHBondContact ND2-OG1 2.77Å; N424-T450 PolarHBondContact OD1-N 3.18Å; N424-T450 PolarHBondContact OD1-OG1 3.25Å; K448-T450 PolarHBondContact O-N 2.81Å; T450-G452 VanDerWaalsContact C-N 3.27Å; T450-G452 PolarHBondContact O-N 3.26Å; T450-C453 VanDerWaalsContact O-CB 3.31Å; T450-C453 WeakPolarHBondContact O-CB 3.32Å; T450-C453 PolarHBondContact O-N 3.07Å; T450-L454 PolarHBondContact O-N 3.49Å
451	E	78.8	Confident	86.7	Confident	83 Å²	83	48.3 Å²	48.3	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-52.4	-44.8	173.8	-171.9	-174.3	163.2	0	0	112.5	C453 L454 L455 L477 M481	E451-C453 PolarHBondContact O-N 2.84Å; E451-L454 PolarHBondContact O-N 3.37Å; E451-L454 VanDerWaalsContact O-N 3.09Å; E451-L455 HydrophobicContact CG-CD1 4.46Å; E451-L455 PolarHBondContact O-N 3.41Å; E451-L477 WeakPolarHBondContact OE2-CD2 3.39Å; E451-M481 VanDerWaalsContact CD-SD 3.56Å; E451-M481 HydrophobicContact CG-CE 4.18Å; E451-M481 HydrophobicContact CG-SD 3.31Å; E451-M481 WeakPolarHBondContact CG-SD 3.11Å
452	G	85.3	Confident	86.5	Confident	40 Å²	40	52.2 Å²	52.2	41%	0.412	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-34.3	177.5	0	0	0	0	0	112.7	T450 L456	T450-G452 VanDerWaalsContact C-N 3.27Å; T450-G452 PolarHBondContact O-N 3.26Å; G452-L456 VanDerWaalsContact O-CG 3.29Å; G452-L456 WeakPolarHBondContact O-CG 3.31Å; G452-L456 PolarHBondContact O-N 3.3Å; G452-L456 VanDerWaalsContact O-N 3.11Å
453	C	86.8	Confident	86.4	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.007	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-42.9	175.3	-169.1	0	0	0	0	112	N424 I449 T450 E451 L455 L456 V457	N424-C453 HydrophobicContact CB-CB 4.02Å; N424-C453 PolarHBondContact O-SG 2.77Å; N424-C453 WeakPolarHBondContact OD1-CB 3.45Å; I449-C453 HydrophobicContact CG2-CB 4.3Å; T450-C453 VanDerWaalsContact O-CB 3.31Å; T450-C453 WeakPolarHBondContact O-CB 3.32Å; T450-C453 PolarHBondContact O-N 3.07Å; E451-C453 PolarHBondContact O-N 2.84Å; C453-L455 VanDerWaalsContact C-N 3.32Å; C453-L455 PolarHBondContact O-N 3.38Å; C453-L456 PolarHBondContact O-N 3.46Å; C453-V457 WeakPolarHBondContact O-CG2 3.44Å; C453-V457 PolarHBondContact O-N 2.96Å
454	L	85.9	Confident	86.5	Confident	28 Å²	28	59.5 Å²	59.5	15%	0.147	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-40.1	176.8	-67.5	176.8	0	0	0	111.7	L427 I443 I449 T450 E451 L456 V457 S458 F469	L427-L454 HydrophobicContact CD2-CD2 4.31Å; I443-L454 HydrophobicContact CD1-CD2 3.79Å; I449-L454 HydrophobicContact CG2-CD2 3.84Å; I449-L454 HydrophobicContact CG2-CG 3.85Å; T450-L454 PolarHBondContact O-N 3.49Å; E451-L454 PolarHBondContact O-N 3.37Å; E451-L454 VanDerWaalsContact O-N 3.09Å; L454-L456 VanDerWaalsContact C-N 3.31Å; L454-L456 PolarHBondContact O-N 2.87Å; L454-V457 PolarHBondContact O-N 3.27Å; L454-S458 WeakPolarHBondContact O-CB 3.48Å; L454-S458 PolarHBondContact O-N 3.3Å; L454-S458 PolarHBondContact O-OG 2.91Å; L454-F469 HydrophobicContact CD1-CD2 4.3Å; L454-F469 HydrophobicContact CD1-CE2 4.12Å
455	L	84.7	Confident	86.9	Confident	72 Å²	72	58.2 Å²	58.2	38%	0.377	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-33.8	174.8	-71.6	174.2	0	0	0	113	E451 C453 S458 R459 M481 F485	E451-L455 HydrophobicContact CG-CD1 4.46Å; E451-L455 PolarHBondContact O-N 3.41Å; C453-L455 VanDerWaalsContact C-N 3.32Å; C453-L455 PolarHBondContact O-N 3.38Å; L455-S458 WeakPolarHBondContact CA-OG 3.46Å; L455-S458 PolarHBondContact O-OG 3Å; L455-R459 WeakPolarHBondContact O-CG 3.48Å; L455-M481 HydrophobicContact CD2-CE 3.48Å; L455-M481 VanDerWaalsContact CD2-CE 3.48Å; L455-M481 HydrophobicContact CD2-SD 4.31Å; L455-M481 HydrophobicContact CG-CE 3.81Å; L455-M481 HydrophobicContact CG-SD 4.47Å; L455-F485 HydrophobicContact CD2-CZ 4.17Å
456	L	84.9	Confident	87.4	Confident	76 Å²	76	65 Å²	65	40%	0.398	34%	0.337	S	S	.	.	H	α-helix	trans	-71.1	-45.7	175.6	-73.5	171	0	0	0	111	G452 C453 L454 S458 R459	G452-L456 VanDerWaalsContact O-CG 3.29Å; G452-L456 WeakPolarHBondContact O-CG 3.31Å; G452-L456 PolarHBondContact O-N 3.3Å; G452-L456 VanDerWaalsContact O-N 3.11Å; C453-L456 PolarHBondContact O-N 3.46Å; L454-L456 VanDerWaalsContact C-N 3.31Å; L454-L456 PolarHBondContact O-N 2.87Å; L456-S458 VanDerWaalsContact C-N 3.33Å; L456-S458 PolarHBondContact O-N 3.02Å; L456-R459 WeakPolarHBondContact O-CB 3.5Å; L456-R459 PolarHBondContact O-N 3Å
457	V	88.2	Confident	87.6	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.03	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-40.3	178.1	169.7	0	0	0	0	111.4	L427 Y435 L441 C453 L454 R459 H460 L461	L427-V457 HydrophobicContact CD2-CG2 3.7Å; L427-V457 HydrophobicContact CG-CG2 3.76Å; Y435-V457 HydrophobicContact CD1-CG1 3.69Å; Y435-V457 HydrophobicContact CD2-CG1 4.38Å; Y435-V457 HydrophobicContact CE1-CG1 3.34Å; Y435-V457 HydrophobicContact CE2-CG1 4.08Å; Y435-V457 HydrophobicContact CE2-CG2 4.26Å; Y435-V457 HydrophobicContact CG-CG1 4.2Å; L441-V457 HydrophobicContact CD2-CG1 4.19Å; C453-V457 WeakPolarHBondContact O-CG2 3.44Å; C453-V457 PolarHBondContact O-N 2.96Å; L454-V457 PolarHBondContact O-N 3.27Å; V457-R459 PolarHBondContact O-N 3.2Å; V457-R459 VanDerWaalsContact O-N 3.15Å; V457-H460 PolarHBondContact O-N 3.27Å; V457-L461 PolarHBondContact O-N 3.37Å
458	S	87.6	Confident	87.8	Confident	27 Å²	27	63 Å²	63	19%	0.189	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-23	-178.5	68	0	0	0	0	113.8	L454 L455 L456 H460 L461 F485	L454-S458 WeakPolarHBondContact O-CB 3.48Å; L454-S458 PolarHBondContact O-N 3.3Å; L454-S458 PolarHBondContact O-OG 2.91Å; L455-S458 WeakPolarHBondContact CA-OG 3.46Å; L455-S458 PolarHBondContact O-OG 3Å; L456-S458 VanDerWaalsContact C-N 3.33Å; L456-S458 PolarHBondContact O-N 3.02Å; S458-H460 PolarHBondContact O-N 3.22Å; S458-L461 PolarHBondContact O-N 3.31Å; S458-F485 VanDerWaalsContact CB-CZ 3.44Å; S458-F485 WeakPolarHBondContact OG-CE1 3.44Å; S458-F485 WeakPolarHBondContact OG-CZ 3.4Å
459	R	92.5	Very high	87.4	Confident	196 Å²	196	59.6 Å²	59.6	74%	0.74	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.8	174.1	-67.7	174.1	179.7	-174.6	-1.3	113	L455 L456 V457	L455-R459 WeakPolarHBondContact O-CG 3.48Å; L456-R459 WeakPolarHBondContact O-CB 3.5Å; L456-R459 PolarHBondContact O-N 3Å; V457-R459 PolarHBondContact O-N 3.2Å; V457-R459 VanDerWaalsContact O-N 3.15Å
460	H	94.4	Very high	86.6	Confident	87 Å²	87	62.3 Å²	62.3	40%	0.403	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-9	179.7	-57.4	-57.4	0	0	0	112.9	P432 Y435 A436 V457 S458	P432-H460 HydrophobicContact CB-CB 4.39Å; Y435-H460 CarbonylContact C-O 3.54Å; Y435-H460 VanDerWaalsContact C-O 3.25Å; Y435-H460 HydrophobicContact CD2-CB 4.14Å; Y435-H460 HydrophobicContact CG-CB 4.23Å; A436-H460 VanDerWaalsContact CA-O 3.26Å; A436-H460 WeakPolarHBondContact CA-O 3.46Å; A436-H460 PolarHBondContact N-O 2.97Å; A436-H460 VanDerWaalsContact N-O 3.08Å; V457-H460 PolarHBondContact O-N 3.27Å; S458-H460 PolarHBondContact O-N 3.22Å
461	L	92.6	Very high	85.6	Confident	22 Å²	22	60 Å²	60	12%	0.115	31%	0.309	C	S	.	.	S	Bend	trans	-78.2	145.9	177.8	-67.2	177.1	0	0	0	110.8	Y435 L438 L441 V457 S458 C465 I467	Y435-L461 HydrophobicContact CD1-CD2 3.82Å; Y435-L461 HydrophobicContact CG-CD2 4.3Å; L438-L461 HydrophobicContact CB-CD2 4.43Å; L438-L461 HydrophobicContact CD1-CD2 4.41Å; L441-L461 HydrophobicContact CD2-CD1 4.12Å; L441-L461 HydrophobicContact CD2-CD2 4.31Å; V457-L461 PolarHBondContact O-N 3.37Å; S458-L461 PolarHBondContact O-N 3.31Å; L461-C465 HydrophobicContact CB-CB 4.23Å; L461-C465 HydrophobicContact CD2-CB 4.48Å; L461-I467 HydrophobicContact CD1-CD1 3.4Å; L461-I467 VanDerWaalsContact CD1-CD1 3.4Å; L461-I467 HydrophobicContact CD1-CG1 3.76Å
462	K	91.9	Very high	84.3	Confident	84 Å²	84	62 Å²	62	37%	0.365	32%	0.322	S	S	.	.			trans	-63.8	147.6	168.1	-82.6	173.8	170	140.5	0	110.4	A436 S464 C465	A436-K462 WeakPolarHBondContact O-CD 3.45Å; A436-K462 WeakPolarHBondContact O-CE 3.43Å; A436-K462 VanDerWaalsContact O-CG 3.32Å; A436-K462 WeakPolarHBondContact O-CG 3.47Å; A436-K462 PolarHBondContact O-NZ 2.65Å; K462-S464 PolarHBondContact O-N 2.82Å; K462-S464 VanDerWaalsContact O-N 3.12Å; K462-C465 HydrophobicContact CB-CB 4.5Å; K462-C465 VanDerWaalsContact O-CB 3.23Å; K462-C465 WeakPolarHBondContact O-CB 3.37Å; K462-C465 PolarHBondContact O-N 2.84Å
463	P	89.6	Confident	82.8	Confident	95 Å²	95	65 Å²	65	62%	0.617	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.1	172.2	-25.8	34.6	0	0	0	113.8	C465 L489	P463-C465 VanDerWaalsContact C-N 3.32Å; P463-L489 VanDerWaalsContact CA-CD2 3.44Å; P463-L489 HydrophobicContact CB-CD2 4.07Å; P463-L489 WeakPolarHBondContact O-CB 3.47Å; P463-L489 WeakPolarHBondContact O-CD1 3.49Å; P463-L489 WeakPolarHBondContact O-CD2 3.14Å; P463-L489 WeakPolarHBondContact O-CG 3.29Å
464	S	91	Very high	81.2	Confident	88 Å²	88	67.6 Å²	67.6	62%	0.615	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-2.6	176	59.1	0	0	0	0	114.3	K462 R466	K462-S464 PolarHBondContact O-N 2.82Å; K462-S464 VanDerWaalsContact O-N 3.12Å; S464-R466 PolarHBondContact O-N 3.39Å
465	C	92.4	Very high	79.8	Confident	2 Å²	2	70 Å²	70	1%	0.014	37%	0.369	C	S	.	.			trans	-72.5	121.4	-178.2	-175.4	0	0	0	0	110.3	L439 L461 K462 P463 I467	L439-C465 WeakPolarHBondContact O-CA 3.32Å; L461-C465 HydrophobicContact CB-CB 4.23Å; L461-C465 HydrophobicContact CD2-CB 4.48Å; K462-C465 HydrophobicContact CB-CB 4.5Å; K462-C465 VanDerWaalsContact O-CB 3.23Å; K462-C465 WeakPolarHBondContact O-CB 3.37Å; K462-C465 PolarHBondContact O-N 2.84Å; P463-C465 VanDerWaalsContact C-N 3.32Å; C465-I467 PolarHBondContact O-N 3.35Å
466	R	90.8	Very high	78.5	Confident	174 Å²	174	72 Å²	72	66%	0.657	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	115.9	172.8	-178.4	178.9	178.1	-178.2	-0.6	109.5	L439 H440 L441 S464	L439-R466 PolarHBondContact O-N 3.22Å; H440-R466 WeakPolarHBondContact CA-O 3.39Å; H440-R466 PolarHBondContact ND1-O 2.91Å; L441-R466 PolarHBondContact N-O 3.31Å; S464-R466 PolarHBondContact O-N 3.39Å
467	I	87.6	Confident	77.2	Confident	40 Å²	40	73 Å²	73	21%	0.205	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130	172.3	-52.7	173	0	0	0	108.3	L441 L461 C465	L441-I467 CarbonylContact O-C 3.33Å; L441-I467 WeakPolarHBondContact O-CA 3.48Å; L461-I467 HydrophobicContact CD1-CD1 3.4Å; L461-I467 VanDerWaalsContact CD1-CD1 3.4Å; L461-I467 HydrophobicContact CD1-CG1 3.76Å; C465-I467 PolarHBondContact O-N 3.35Å
468	S	85.8	Confident	75.8	Confident	23 Å²	23	74.5 Å²	74.5	16%	0.161	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.9	171.7	-68.4	0	0	0	0	108.2	H440 L441 E442 I443	H440-S468 PolarHBondContact CE1-OG 3.34Å; L441-S468 PolarHBondContact O-N 3.39Å; E442-S468 CarbonylContact C-O 3.47Å; E442-S468 WeakPolarHBondContact CA-O 3.48Å; I443-S468 PolarHBondContact N-O 3.01Å
469	F	76.9	Confident	74.8	Confident	22 Å²	22	77.7 Å²	77.7	10%	0.096	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	106.2	179.3	-170.7	-95	0	0	0	107.8	I443 L454 N471 I478 L482	I443-F469 HydrophobicContact CB-CD2 3.86Å; I443-F469 HydrophobicContact CB-CE2 4.25Å; I443-F469 HydrophobicContact CG2-CD2 3.98Å; I443-F469 HydrophobicContact CG2-CE2 3.82Å; I443-F469 WeakPolarHBondContact O-CA 3.42Å; L454-F469 HydrophobicContact CD1-CD2 4.3Å; L454-F469 HydrophobicContact CD1-CE2 4.12Å; F469-N471 HydrophobicContact CD1-CB 3.7Å; F469-N471 HydrophobicContact CE1-CB 3.12Å; F469-N471 HydrophobicContact CZ-CB 3.8Å; F469-I478 HydrophobicContact CD1-CD1 4.46Å; F469-I478 HydrophobicContact CD1-CG2 3.51Å; F469-I478 HydrophobicContact CE1-CD1 3.6Å; F469-I478 HydrophobicContact CE1-CG2 3.73Å; F469-I478 HydrophobicContact CG-CG2 4.31Å; F469-I478 HydrophobicContact CZ-CD1 4.14Å; F469-L482 HydrophobicContact CB-CD1 4.26Å; F469-L482 HydrophobicContact CB-CD2 4.21Å
470	V	65.4	Low	73.5	Confident	72 Å²	72	70.8 Å²	70.8	44%	0.436	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	90.9	179.2	-173.4	0	0	0	0	106.5	I443 H444 D445	I443-V470 PolarHBondContact O-N 3.3Å; H444-V470 CarbonylContact C-O 3.49Å; H444-V470 WeakPolarHBondContact CA-O 3.31Å; H444-V470 VanDerWaalsContact ND1-CB 3.31Å; H444-V470 WeakPolarHBondContact ND1-CB 3.31Å; D445-V470 PolarHBondContact N-O 2.83Å
471	N	64.3	Low	71.9	Confident	22 Å²	22	67.7 Å²	67.7	12%	0.118	38%	0.383	C	S	.	.			trans	-110.1	118	174.5	-174.9	-16	0	0	0	108.3	F469 C473 S474	F469-N471 HydrophobicContact CD1-CB 3.7Å; F469-N471 HydrophobicContact CE1-CB 3.12Å; F469-N471 HydrophobicContact CZ-CB 3.8Å; N471-C473 PolarHBondContact O-N 3.31Å; N471-C473 VanDerWaalsContact O-N 3.09Å; N471-C473 WeakPolarHBondContact OD1-CA 3.3Å; N471-C473 WeakPolarHBondContact OD1-CB 3.47Å; N471-C473 PolarHBondContact OD1-N 3.24Å; N471-S474 WeakPolarHBondContact O-CB 3.31Å; N471-S474 PolarHBondContact O-N 3.24Å
472	L	52.5	Low	70.7	Confident	127 Å²	127	68.1 Å²	68.1	67%	0.665	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.2	177	-66.7	170.6	0	0	0	112.2	W419	W419-L472 HydrophobicContact CH2-CD1 3.94Å; W419-L472 HydrophobicContact CZ2-CD1 3.91Å
473	C	53.9	Low	69.8	Low	101 Å²	101	67.5 Å²	67.5	68%	0.682	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	19.4	175.6	-60.2	0	0	0	0	113.8	N471 T475	N471-C473 PolarHBondContact O-N 3.31Å; N471-C473 VanDerWaalsContact O-N 3.09Å; N471-C473 WeakPolarHBondContact OD1-CA 3.3Å; N471-C473 WeakPolarHBondContact OD1-CB 3.47Å; N471-C473 PolarHBondContact OD1-N 3.24Å; C473-T475 PolarHBondContact O-N 3.46Å; C473-T475 VanDerWaalsContact O-N 3.07Å
474	S	52.1	Low	68.7	Low	56 Å²	56	70.9 Å²	70.9	39%	0.392	39%	0.386	S	S	.	.			trans	-53.1	118.9	-174	64.9	0	0	0	0	112	N471	N471-S474 WeakPolarHBondContact O-CB 3.31Å; N471-S474 PolarHBondContact O-N 3.24Å
475	T	56.3	Low	67.5	Low	78 Å²	78	68.1 Å²	68.1	48%	0.479	36%	0.363	S	S	.	.			trans	-67.3	149.5	167.2	54.2	0	0	0	0	109.1	C473 L477 I478	C473-T475 PolarHBondContact O-N 3.46Å; C473-T475 VanDerWaalsContact O-N 3.07Å; T475-L477 PolarHBondContact O-N 3.33Å; T475-I478 PolarHBondContact O-N 3.06Å
476	P	58.1	Low	66.4	Low	116 Å²	116	72.8 Å²	72.8	75%	0.753	39%	0.388	S	S	*	.	H	α-helix	trans	-49.5	-25.1	176.1	-29	34.7	0	0	0	114.4	Q479 A480	P476-Q479 PolarHBondContact O-N 3.19Å; P476-A480 PolarHBondContact O-N 3.08Å
477	L	56.7	Low	65.4	Low	96 Å²	96	72.3 Å²	72.3	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-65.4	-41.3	178.3	-163.1	75.1	0	0	0	113.1	E451 T475 Q479 A480 M481	E451-L477 WeakPolarHBondContact OE2-CD2 3.39Å; T475-L477 PolarHBondContact O-N 3.33Å; L477-Q479 VanDerWaalsContact C-N 3.33Å; L477-Q479 PolarHBondContact O-N 2.98Å; L477-A480 WeakPolarHBondContact O-CB 3.38Å; L477-A480 PolarHBondContact O-N 2.61Å; L477-M481 PolarHBondContact O-N 3.25Å
478	I	60.1	Low	64.5	Low	36 Å²	36	75.8 Å²	75.8	19%	0.185	40%	0.402	C	S	.	.	H	α-helix	trans	-65.7	-40.8	178.7	-63.3	179.9	0	0	0	110	F469 T475 A480 M481 L482	F469-I478 HydrophobicContact CD1-CD1 4.46Å; F469-I478 HydrophobicContact CD1-CG2 3.51Å; F469-I478 HydrophobicContact CE1-CD1 3.6Å; F469-I478 HydrophobicContact CE1-CG2 3.73Å; F469-I478 HydrophobicContact CG-CG2 4.31Å; F469-I478 HydrophobicContact CZ-CD1 4.14Å; T475-I478 PolarHBondContact O-N 3.06Å; I478-A480 VanDerWaalsContact C-N 3.35Å; I478-A480 PolarHBondContact O-N 3.46Å; I478-M481 WeakPolarHBondContact O-CB 3.35Å; I478-M481 PolarHBondContact O-N 2.88Å; I478-M481 VanDerWaalsContact O-N 3.16Å; I478-L482 WeakPolarHBondContact O-CG 3.39Å; I478-L482 PolarHBondContact O-N 3.09Å
479	Q	65.7	Low	63.2	Low	94 Å²	94	77.7 Å²	77.7	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-42.3	175	-164.7	65.8	39.1	0	0	111.4	P476 L477 M481 L482 N483	P476-Q479 PolarHBondContact O-N 3.19Å; L477-Q479 VanDerWaalsContact C-N 3.33Å; L477-Q479 PolarHBondContact O-N 2.98Å; Q479-M481 PolarHBondContact O-N 3.01Å; Q479-L482 PolarHBondContact O-N 3.46Å; Q479-N483 WeakPolarHBondContact O-CB 3.49Å; Q479-N483 PolarHBondContact O-N 3.25Å; Q479-N483 PolarHBondContact O-ND2 2.98Å; Q479-N483 PolarHBondContact O-OD1 3.02Å
480	A	64.6	Low	63	Low	52 Å²	52	82.4 Å²	82.4	43%	0.43	44%	0.441	S	S	.	.	H	α-helix	trans	-61.3	-34.3	175	0	0	0	0	0	112.2	P476 L477 I478 R484	P476-A480 PolarHBondContact O-N 3.08Å; L477-A480 WeakPolarHBondContact O-CB 3.38Å; L477-A480 PolarHBondContact O-N 2.61Å; I478-A480 VanDerWaalsContact C-N 3.35Å; I478-A480 PolarHBondContact O-N 3.46Å; A480-R484 WeakPolarHBondContact O-CB 3.48Å; A480-R484 PolarHBondContact O-N 2.88Å
481	M	62.4	Low	62.9	Low	22 Å²	22	85.5 Å²	85.5	11%	0.108	47%	0.466	C	S	.	.	H	α-helix	trans	-73.5	-42.1	174.3	-94	-168.2	54.6	0	0	113.9	E451 L455 L477 I478 Q479 N483 R484 F485	E451-M481 VanDerWaalsContact CD-SD 3.56Å; E451-M481 HydrophobicContact CG-CE 4.18Å; E451-M481 HydrophobicContact CG-SD 3.31Å; E451-M481 WeakPolarHBondContact CG-SD 3.11Å; L455-M481 HydrophobicContact CD2-CE 3.48Å; L455-M481 VanDerWaalsContact CD2-CE 3.48Å; L455-M481 HydrophobicContact CD2-SD 4.31Å; L455-M481 HydrophobicContact CG-CE 3.81Å; L455-M481 HydrophobicContact CG-SD 4.47Å; L477-M481 PolarHBondContact O-N 3.25Å; I478-M481 WeakPolarHBondContact O-CB 3.35Å; I478-M481 PolarHBondContact O-N 2.88Å; I478-M481 VanDerWaalsContact O-N 3.16Å; Q479-M481 PolarHBondContact O-N 3.01Å; M481-N483 PolarHBondContact O-N 3.35Å; M481-R484 CarbonylContact O-C 3.6Å; M481-R484 WeakPolarHBondContact O-CA 3.12Å; M481-R484 WeakPolarHBondContact O-CB 3.42Å; M481-R484 PolarHBondContact O-N 3.45Å; M481-F485 HydrophobicContact CE-CD2 4.3Å; M481-F485 HydrophobicContact CE-CE2 3.39Å; M481-F485 HydrophobicContact CE-CZ 3.97Å; M481-F485 VanDerWaalsContact O-CD2 3.28Å; M481-F485 WeakPolarHBondContact O-CD2 3.24Å; M481-F485 PolarHBondContact O-N 3.37Å
482	L	66.7	Low	62.8	Low	31 Å²	31	88.7 Å²	88.7	16%	0.162	48%	0.484	C	S	.	.	H	α-helix	trans	-57.1	-43.6	171.8	-70.5	173.2	0	0	0	110	F469 I478 Q479 R484 F485 D486	F469-L482 HydrophobicContact CB-CD1 4.26Å; F469-L482 HydrophobicContact CB-CD2 4.21Å; I478-L482 WeakPolarHBondContact O-CG 3.39Å; I478-L482 PolarHBondContact O-N 3.09Å; Q479-L482 PolarHBondContact O-N 3.46Å; L482-R484 PolarHBondContact O-N 3.49Å; L482-F485 PolarHBondContact O-N 2.96Å; L482-D486 PolarHBondContact O-N 3.15Å
483	N	71.9	Confident	63.3	Low	71 Å²	71	86.7 Å²	86.7	38%	0.38	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-25.1	173.5	-63.4	-13	0	0	0	113.1	Q479 M481 R487	Q479-N483 WeakPolarHBondContact O-CB 3.49Å; Q479-N483 PolarHBondContact O-N 3.25Å; Q479-N483 PolarHBondContact O-ND2 2.98Å; Q479-N483 PolarHBondContact O-OD1 3.02Å; M481-N483 PolarHBondContact O-N 3.35Å; N483-R487 VanDerWaalsContact O-CG 3.31Å; N483-R487 WeakPolarHBondContact O-CG 3.47Å; N483-R487 PolarHBondContact O-N 3.38Å; N483-R487 PolarHBondContact O-NE 2.96Å
484	R	68.1	Low	63.9	Low	166 Å²	166	85.9 Å²	85.9	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-79.7	-38.8	174.2	-173.5	178.8	179.6	172.2	1.5	111	A480 M481 L482 R487 M488	A480-R484 WeakPolarHBondContact O-CB 3.48Å; A480-R484 PolarHBondContact O-N 2.88Å; M481-R484 CarbonylContact O-C 3.6Å; M481-R484 WeakPolarHBondContact O-CA 3.12Å; M481-R484 WeakPolarHBondContact O-CB 3.42Å; M481-R484 PolarHBondContact O-N 3.45Å; L482-R484 PolarHBondContact O-N 3.49Å; R484-R487 WeakPolarHBondContact O-CB 3.29Å; R484-R487 PolarHBondContact O-N 2.62Å; R484-M488 WeakPolarHBondContact O-CG 3.48Å; R484-M488 PolarHBondContact O-N 2.87Å
485	F	65.1	Low	64.6	Low	29 Å²	29	87.6 Å²	87.6	13%	0.127	47%	0.467	C	S	.	.	H	α-helix	trans	-62.2	-52.5	172.9	-81.8	-61.7	0	0	0	110.1	L455 S458 M481 L482 R487 M488 L489	L455-F485 HydrophobicContact CD2-CZ 4.17Å; S458-F485 VanDerWaalsContact CB-CZ 3.44Å; S458-F485 WeakPolarHBondContact OG-CE1 3.44Å; S458-F485 WeakPolarHBondContact OG-CZ 3.4Å; M481-F485 HydrophobicContact CE-CD2 4.3Å; M481-F485 HydrophobicContact CE-CE2 3.39Å; M481-F485 HydrophobicContact CE-CZ 3.97Å; M481-F485 VanDerWaalsContact O-CD2 3.28Å; M481-F485 WeakPolarHBondContact O-CD2 3.24Å; M481-F485 PolarHBondContact O-N 3.37Å; L482-F485 PolarHBondContact O-N 2.96Å; F485-R487 PolarHBondContact O-N 3.06Å; F485-R487 VanDerWaalsContact O-N 3.13Å; F485-M488 CarbonylContact O-C 3.29Å; F485-M488 WeakPolarHBondContact O-CA 3.3Å; F485-M488 PolarHBondContact O-N 3.44Å; F485-L489 VanDerWaalsContact O-CG 3.28Å; F485-L489 WeakPolarHBondContact O-CG 3.46Å; F485-L489 PolarHBondContact O-N 3.32Å
486	D	68.7	Low	65.1	Low	100 Å²	100	88.3 Å²	88.3	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-51.9	-42.3	175.7	-77.8	-14.8	0	0	0	111	L482 L489 T490	L482-D486 PolarHBondContact O-N 3.15Å; D486-L489 PolarHBondContact O-N 3.29Å; D486-T490 WeakPolarHBondContact O-CB 3.39Å; D486-T490 VanDerWaalsContact O-CG2 3.27Å; D486-T490 WeakPolarHBondContact O-CG2 3.17Å; D486-T490 PolarHBondContact O-N 3.27Å; D486-T490 PolarHBondContact O-OG1 3.04Å
487	R	71.2	Confident	65.5	Low	165 Å²	165	86.4 Å²	86.4	62%	0.623	45%	0.447	S	S	*	.	H	α-helix	trans	-62.3	-47.8	174	-80.4	-176.2	-85.1	-177	-5.9	113.4	N483 R484 F485 L489 T490 S491	N483-R487 VanDerWaalsContact O-CG 3.31Å; N483-R487 WeakPolarHBondContact O-CG 3.47Å; N483-R487 PolarHBondContact O-N 3.38Å; N483-R487 PolarHBondContact O-NE 2.96Å; R484-R487 WeakPolarHBondContact O-CB 3.29Å; R484-R487 PolarHBondContact O-N 2.62Å; F485-R487 PolarHBondContact O-N 3.06Å; F485-R487 VanDerWaalsContact O-N 3.13Å; R487-L489 PolarHBondContact O-N 3.4Å; R487-T490 WeakPolarHBondContact CA-OG1 3.32Å; R487-T490 PolarHBondContact O-N 2.99Å; R487-T490 PolarHBondContact O-OG1 3.11Å; R487-S491 PolarHBondContact O-N 3.32Å; R487-S491 VanDerWaalsContact O-N 3.07Å; R487-S491 PolarHBondContact O-OG 2.64Å
488	M	67.5	Low	66.2	Low	112 Å²	112	85.7 Å²	85.7	55%	0.552	44%	0.443	S	S	*	.	H	α-helix	trans	-64.6	-27	177.5	-75.6	-176	61.8	0	0	113.3	R484 F485 S491	R484-M488 WeakPolarHBondContact O-CG 3.48Å; R484-M488 PolarHBondContact O-N 2.87Å; F485-M488 CarbonylContact O-C 3.29Å; F485-M488 WeakPolarHBondContact O-CA 3.3Å; F485-M488 PolarHBondContact O-N 3.44Å; M488-S491 PolarHBondContact O-OG 3.49Å
489	L	59.6	Low	66.6	Low	63 Å²	63	89.5 Å²	89.5	33%	0.33	46%	0.463	S	S	.	.	H	α-helix	trans	-84.8	-26.5	178.1	-60.9	-175.2	0	0	0	112.2	P463 F485 D486 R487	P463-L489 VanDerWaalsContact CA-CD2 3.44Å; P463-L489 HydrophobicContact CB-CD2 4.07Å; P463-L489 WeakPolarHBondContact O-CB 3.47Å; P463-L489 WeakPolarHBondContact O-CD1 3.49Å; P463-L489 WeakPolarHBondContact O-CD2 3.14Å; P463-L489 WeakPolarHBondContact O-CG 3.29Å; F485-L489 VanDerWaalsContact O-CG 3.28Å; F485-L489 WeakPolarHBondContact O-CG 3.46Å; F485-L489 PolarHBondContact O-N 3.32Å; D486-L489 PolarHBondContact O-N 3.29Å; R487-L489 PolarHBondContact O-N 3.4Å
490	T	72.1	Confident	66.7	Low	121 Å²	121	89.2 Å²	89.2	74%	0.742	47%	0.465	S	S	*	.	H	α-helix	trans	-84.6	-18.1	174.7	56	0	0	0	0	114.4	D486 R487	D486-T490 WeakPolarHBondContact O-CB 3.39Å; D486-T490 VanDerWaalsContact O-CG2 3.27Å; D486-T490 WeakPolarHBondContact O-CG2 3.17Å; D486-T490 PolarHBondContact O-N 3.27Å; D486-T490 PolarHBondContact O-OG1 3.04Å; R487-T490 WeakPolarHBondContact CA-OG1 3.32Å; R487-T490 PolarHBondContact O-N 2.99Å; R487-T490 PolarHBondContact O-OG1 3.11Å
491	S	62.7	Low	66.9	Low	138 Å²	138	92.5 Å²	92.5	97%	0.965	47%	0.468	S	S	*	.			trans	-89.4	0	175	64.1	0	0	0	0	111.2	R487 M488	R487-S491 PolarHBondContact O-N 3.32Å; R487-S491 VanDerWaalsContact O-N 3.07Å; R487-S491 PolarHBondContact O-OG 2.64Å; M488-S491 PolarHBondContact O-OG 3.49Å

Retrieved 491 of 491 residues in 552.8 ms (Link to these results)

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