A0A087XCT0_POEFO Loading...

Superoxide dismutase copper chaperone

AlphaFold DB , UniProt , Accession A0A087XCT0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 307 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	40	Very low	35.4	Very low	249 Å²	249	137.1 Å²	137.1	100%	1.227	84%	0.84	S	S	*	*				0	147.7	0	-69	-178.1	-173.7	0	0	107.8
2	A	34.8	Very low	35	Very low	101 Å²	101	138.5 Å²	138.5	84%	0.835	84%	0.836	S	S	*	*			trans	-59.1	152.2	-150.4	0	0	0	0	0	118.8
3	A	31	Very low	34.6	Very low	86 Å²	86	136.4 Å²	136.4	71%	0.711	83%	0.831	S	S	*	*			trans	-80.6	-160.8	152.6	0	0	0	0	0	109.5
4	P	54.5	Low	34.5	Very low	114 Å²	114	133.1 Å²	133.1	74%	0.74	83%	0.826	S	S	*	*			cis	-137.2	-167.5	-17.8	24.9	0.6	0	0	0	113.4
5	V	35.2	Very low	34.6	Very low	133 Å²	133	131.3 Å²	131.3	81%	0.806	82%	0.819	S	S	*	*			trans	133.6	125.1	132.3	-179.7	0	0	0	0	116.6
6	S	32.3	Very low	34.8	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	83%	0.825	S	S	*	*			trans	-72.4	153.8	168.6	161.6	0	0	0	0	113.2
7	L	34.8	Very low	34.7	Very low	172 Å²	172	141.8 Å²	141.8	90%	0.901	83%	0.828	S	S	*	*				-161	135.1	126.2	-130.3	85.5	0	0	0	112.6
8	A	33	Very low	34.8	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	83%	0.827	S	S	*	*			trans	-80	157	171.5	0	0	0	0	0	112.3
9	G	29	Very low	34.6	Very low	78 Å²	78	139.5 Å²	139.5	80%	0.804	82%	0.815	S	S	*	*			trans	-161.5	101	165.3	0	0	0	0	0	111.5
10	R	33.6	Very low	34.5	Very low	245 Å²	245	144.8 Å²	144.8	93%	0.925	82%	0.82	S	S	*	*			trans	-56.3	151.9	168.9	-75.4	170.3	164.7	177.6	-5.2	110.9
11	V	31	Very low	34.4	Very low	143 Å²	143	146.5 Å²	146.5	87%	0.867	82%	0.819	S	S	*	*				-169.2	144.7	118.6	165.4	0	0	0	0	109.8
12	I	31.2	Very low	34.2	Very low	154 Å²	154	142.5 Å²	142.5	79%	0.79	80%	0.802	S	S	*	*			trans	-78.3	166.5	-173.9	-64.6	154.9	0	0	0	111.5
13	S	29.8	Very low	34.2	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	80%	0.795	S	S	*	*			trans	87.3	112.3	152	167.4	0	0	0	0	118.2
14	A	33.4	Very low	34.3	Very low	91 Å²	91	147.3 Å²	147.3	75%	0.752	80%	0.8	S	S	*	*				167	121.2	94.7	0	0	0	0	0	111.7
15	S	35.8	Very low	33.3	Very low	105 Å²	105	146 Å²	146	73%	0.734	79%	0.793	S	S	*	*			trans	1.3	135.8	149.9	-70.4	0	0	0	0	121.7
16	R	37.5	Very low	33.1	Very low	240 Å²	240	145.3 Å²	145.3	91%	0.906	79%	0.79	S	S	*	*			trans	68.2	99.2	133.7	-63.9	178.1	-167.9	-149.3	2.3	118.2
17	K	33.2	Very low	33	Very low	201 Å²	201	150 Å²	150	87%	0.874	80%	0.798	S	S	*	*			trans	-137.3	140	148.1	-81.5	-178	-179.5	178.6	0	104.8
18	L	36.2	Very low	32.9	Very low	154 Å²	154	148.3 Å²	148.3	81%	0.806	79%	0.789	S	S	*	*			cis	-161.1	145.8	19.5	-112.8	143.3	0	0	0	107.5
19	S	30.4	Very low	32.7	Very low	86 Å²	86	148.3 Å²	148.3	60%	0.601	79%	0.789	S	S	*	*			trans	-29.9	131.3	167.5	-173.1	0	0	0	0	116.1
20	R	33.8	Very low	32.7	Very low	246 Å²	246	153.2 Å²	153.2	93%	0.928	79%	0.791	S	S	*	*			trans	-127.8	82.8	148.6	-87.5	-175.1	176.4	-179.4	-1.4	107.8	L22	R20-L22 PolarHBondContact O-N 2.89Å
21	F	32.4	Very low	32.6	Very low	181 Å²	181	145.8 Å²	145.8	79%	0.794	78%	0.782	S	S	*	*			trans	-71.4	111.6	159.8	-97.6	-95	0	0	0	107.7	I23	F21-I23 PolarHBondContact O-N 3.28Å
22	L	34.4	Very low	32.4	Very low	165 Å²	165	142.1 Å²	142.1	86%	0.864	77%	0.773	S	S	*	*			trans	-71.4	100.9	163.4	-79.1	158.6	0	0	0	107.3	R20	R20-L22 PolarHBondContact O-N 2.89Å
23	I	36.4	Very low	32.2	Very low	135 Å²	135	140.4 Å²	140.4	69%	0.692	77%	0.77	S	S	*	*			trans	-84.7	109.7	163.6	-60.5	174.5	0	0	0	105.6	F21 S25	F21-I23 PolarHBondContact O-N 3.28Å; I23-S25 VanDerWaalsContact C-N 3.29Å; I23-S25 PolarHBondContact O-N 2.95Å
24	N	32	Very low	32.1	Very low	152 Å²	152	140.7 Å²	140.7	81%	0.813	77%	0.767	S	S	*	*			trans	-65.8	93.1	163	-92.1	-10	0	0	0	107.7	V26	N24-V26 PolarHBondContact O-N 2.98Å; N24-V26 VanDerWaalsContact O-N 3.1Å
25	S	33.6	Very low	32	Very low	86 Å²	86	141 Å²	141	60%	0.601	76%	0.759	S	S	*	*			trans	-73.1	96.2	167.8	-46.4	0	0	0	0	107.8	I23 F27	I23-S25 VanDerWaalsContact C-N 3.29Å; I23-S25 PolarHBondContact O-N 2.95Å; S25-F27 PolarHBondContact O-N 3.12Å
26	V	31.6	Very low	31.9	Very low	120 Å²	120	142.6 Å²	142.6	73%	0.727	75%	0.754	S	S	*	*			trans	-63.7	103.2	163.6	176.9	0	0	0	0	106.4	N24 I28	N24-V26 PolarHBondContact O-N 2.98Å; N24-V26 VanDerWaalsContact O-N 3.1Å; V26-I28 VanDerWaalsContact C-N 3.28Å; V26-I28 HydrophobicContact CG1-CG1 3.92Å; V26-I28 PolarHBondContact O-N 3.28Å
27	F	29.5	Very low	31.9	Very low	191 Å²	191	138.1 Å²	138.1	84%	0.838	75%	0.749	S	S	*	*			trans	-68.7	94.6	163.3	-83.7	-87.2	0	0	0	106.9	S25 A29	S25-F27 PolarHBondContact O-N 3.12Å; F27-A29 VanDerWaalsContact C-N 3.28Å; F27-A29 PolarHBondContact O-N 3.31Å
28	I	32.3	Very low	32.7	Very low	138 Å²	138	130.9 Å²	130.9	71%	0.708	72%	0.719	S	S	*	*			trans	-67.7	98.1	161.5	-60.8	178.9	0	0	0	104.9	V26 Q30	V26-I28 VanDerWaalsContact C-N 3.28Å; V26-I28 HydrophobicContact CG1-CG1 3.92Å; V26-I28 PolarHBondContact O-N 3.28Å; I28-Q30 VanDerWaalsContact C-N 3.29Å; I28-Q30 PolarHBondContact O-N 3.24Å
29	A	30.5	Very low	34	Very low	92 Å²	92	129.3 Å²	129.3	76%	0.76	71%	0.711	S	S	*	*			trans	-61.1	100.4	162.1	0	0	0	0	0	106.3	F27 A31	F27-A29 VanDerWaalsContact C-N 3.28Å; F27-A29 PolarHBondContact O-N 3.31Å; A29-A31 VanDerWaalsContact C-N 3.26Å; A29-A31 PolarHBondContact O-N 3.18Å
30	Q	27.7	Very low	36.2	Very low	181 Å²	181	126.2 Å²	126.2	85%	0.846	69%	0.689	S	S	*	*			trans	-62.9	100.1	160.2	-80.2	-179.6	-61.2	0	0	105.8	I28 G32	I28-Q30 VanDerWaalsContact C-N 3.29Å; I28-Q30 PolarHBondContact O-N 3.24Å; Q30-G32 PolarHBondContact O-N 2.59Å
31	A	31.8	Very low	38.4	Very low	90 Å²	90	122.9 Å²	122.9	74%	0.744	68%	0.683	S	S	*	*			trans	-59.4	96.5	157.8	0	0	0	0	0	105.8	A29 T33	A29-A31 VanDerWaalsContact C-N 3.26Å; A29-A31 PolarHBondContact O-N 3.18Å; A31-T33 VanDerWaalsContact C-N 3.3Å; A31-T33 PolarHBondContact O-N 3.34Å
32	G	26.1	Very low	41	Very low	66 Å²	66	119.4 Å²	119.4	68%	0.68	67%	0.665	S	S	*	*			trans	-62.8	99.8	166.8	0	0	0	0	0	106.8	Q30 V34	Q30-G32 PolarHBondContact O-N 2.59Å; G32-V34 PolarHBondContact O-N 3.11Å
33	T	28.5	Very low	43.5	Very low	118 Å²	118	112.2 Å²	112.2	72%	0.724	63%	0.628	S	S	*	*			trans	-59.9	104.7	161.7	43.5	0	0	0	0	106.4	A31 V35	A31-T33 VanDerWaalsContact C-N 3.3Å; A31-T33 PolarHBondContact O-N 3.34Å; T33-V35 PolarHBondContact O-N 2.75Å
34	V	28	Very low	46.1	Very low	117 Å²	117	105.9 Å²	105.9	71%	0.709	60%	0.596	S	S	*	*			trans	-66.3	91.6	160.7	179.7	0	0	0	0	105	G32 H36	G32-V34 PolarHBondContact O-N 3.11Å; V34-H36 VanDerWaalsContact C-N 3.27Å; V34-H36 PolarHBondContact O-N 3.26Å
35	V	29.4	Very low	49	Very low	98 Å²	98	101.3 Å²	101.3	59%	0.594	57%	0.569	S	S	*	*			trans	-71.6	92.9	169.9	-177.2	0	0	0	0	105.1	T33 N37	T33-V35 PolarHBondContact O-N 2.75Å; V35-N37 VanDerWaalsContact C-N 3.33Å; V35-N37 PolarHBondContact O-N 2.97Å
36	H	35	Very low	51.8	Low	137 Å²	137	97.2 Å²	97.2	63%	0.634	54%	0.54	S	S	*	.			trans	-63	105.9	160.9	-82.7	-72.1	0	0	0	105.9	V34 M38	V34-H36 VanDerWaalsContact C-N 3.27Å; V34-H36 PolarHBondContact O-N 3.26Å; H36-M38 HydrophobicContact CB-CG 4.5Å; H36-M38 PolarHBondContact O-N 3.19Å
37	N	36.4	Very low	54.7	Low	147 Å²	147	91.7 Å²	91.7	79%	0.786	51%	0.506	S	S	*	.			trans	-70.8	73.9	-178	-140.6	34	0	0	0	108.2	V35	V35-N37 VanDerWaalsContact C-N 3.33Å; V35-N37 PolarHBondContact O-N 2.97Å
38	M	50.4	Low	57.7	Low	49 Å²	49	82.6 Å²	82.6	24%	0.241	47%	0.466	C	S	.	.			trans	-97.9	-10.3	174.1	-71.8	-173.5	73.9	0	0	111.3	H36 T40 F214	H36-M38 HydrophobicContact CB-CG 4.5Å; H36-M38 PolarHBondContact O-N 3.19Å; M38-T40 PolarHBondContact O-N 3.5Å; M38-F214 HydrophobicContact CB-CB 4.07Å; M38-F214 HydrophobicContact CE-CB 4.14Å; M38-F214 HydrophobicContact CE-CD1 3.55Å; M38-F214 HydrophobicContact CE-CD2 3.91Å; M38-F214 HydrophobicContact CE-CE1 3.77Å; M38-F214 HydrophobicContact CE-CE2 4.12Å; M38-F214 HydrophobicContact CE-CG 3.62Å; M38-F214 HydrophobicContact CE-CZ 4.06Å; M38-F214 VanDerWaalsContact O-CA 3.25Å; M38-F214 WeakPolarHBondContact O-CA 3.37Å; M38-F214 WeakPolarHBondContact O-CB 3.36Å
39	D	63.4	Low	60.6	Low	120 Å²	120	76.4 Å²	76.4	64%	0.642	44%	0.436	S	S	*	.			trans	-70.8	118.6	178.1	-63.3	-27.5	0	0	0	110.6
40	T	76.4	Confident	63.5	Low	22 Å²	22	72 Å²	72	14%	0.135	40%	0.4	C	S	.	.			trans	-85.1	134.8	169.3	171.6	0	0	0	0	111.2	M38 R42 L145 R213 E215	M38-T40 PolarHBondContact O-N 3.5Å; T40-R42 VanDerWaalsContact C-N 3.31Å; T40-R42 WeakPolarHBondContact OG1-CB 3.27Å; T40-R42 PolarHBondContact OG1-N 3.32Å; T40-L145 HydrophobicContact CG2-CD1 3.55Å; T40-R213 HydrophobicContact CG2-CG 3.88Å; T40-E215 WeakPolarHBondContact CB-OE1 3.21Å; T40-E215 HydrophobicContact CG2-CG 4.09Å; T40-E215 PolarHBondContact OG1-OE1 2.85Å
41	E	81.3	Confident	66.3	Low	175 Å²	175	67.9 Å²	67.9	82%	0.818	38%	0.381	S	S	*	.			trans	-86.8	-2	171.1	-61.6	-172.1	166.9	0	0	112.9	A88	E41-A88 WeakPolarHBondContact O-CB 3.39Å
42	R	86.5	Confident	68.9	Low	108 Å²	108	63.8 Å²	63.8	41%	0.408	35%	0.346	S	S	.	.			trans	-73.4	127.2	-178.3	-168.4	178	-97.5	167.1	-17.7	109.4	T40 L139 D143 R213 E215	T40-R42 VanDerWaalsContact C-N 3.31Å; T40-R42 WeakPolarHBondContact OG1-CB 3.27Å; T40-R42 PolarHBondContact OG1-N 3.32Å; R42-L139 HydrophobicContact CG-CD1 4.41Å; R42-D143 IonicContact CZ-OD2 2.72Å; R42-D143 IonicContact NH1-OD2 3.94Å; R42-D143 PolarHBondContact NH1-OD2 2.9Å; R42-D143 IonicContact NH2-OD2 3.62Å; R42-R213 PolarHBondContact O-NH2 2.9Å; R42-E215 WeakPolarHBondContact CB-OE1 3.19Å; R42-E215 IonicContact CZ-OE2 3.74Å; R42-E215 IonicContact NH1-OE2 3.33Å; R42-E215 PolarHBondContact NH1-OE2 2.96Å
43	P	87.8	Confident	71.8	Confident	15 Å²	15	66.5 Å²	66.5	10%	0.097	35%	0.35	C	S	.	.			trans	-73.4	149.2	-179.1	-1.4	16	0	0	0	111.4	K72 E86 A87	P43-K72 HydrophobicContact CB-CD 4.05Å; P43-K72 HydrophobicContact CG-CD 3.37Å; P43-K72 HydrophobicContact CG-CG 4.24Å; P43-E86 HydrophobicContact CB-CG 3.69Å; P43-A87 WeakPolarHBondContact CA-O 3.49Å
44	A	90.1	Very high	74.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.008	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	154.6	162.9	0	0	0	0	0	108.5	E86 A87 I110 L137 L145	A44-E86 WeakPolarHBondContact O-CA 3.38Å; A44-A87 PolarHBondContact N-O 3.08Å; A44-A87 PolarHBondContact O-N 3.17Å; A44-I110 HydrophobicContact CB-CG1 4.45Å; A44-L137 HydrophobicContact CB-CD2 4.07Å; A44-L145 HydrophobicContact CB-CD2 3.72Å
45	K	92.6	Very high	77.9	Confident	57 Å²	57	62.9 Å²	62.9	25%	0.248	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.7	172.4	-70.1	174.2	-171.6	159.2	0	108.6	L84 V85 E86 I110 G111 S113 L267	K45-L84 HydrophobicContact CB-CD1 4.31Å; K45-V85 CarbonylContact C-O 3.55Å; K45-V85 WeakPolarHBondContact CA-O 3.44Å; K45-E86 HydrophobicContact CG-CB 4.31Å; K45-E86 HydrophobicContact CG-CG 4.25Å; K45-I110 WeakPolarHBondContact O-CA 3.33Å; K45-G111 PolarHBondContact N-O 2.88Å; K45-G111 PolarHBondContact O-N 3.34Å; K45-S113 PolarHBondContact NZ-O 3.12Å; K45-S113 VanDerWaalsContact NZ-O 3.17Å; K45-L267 HydrophobicContact CB-CD1 3.59Å; K45-L267 HydrophobicContact CB-CD2 4.2Å; K45-L267 HydrophobicContact CB-CG 4.49Å; K45-L267 HydrophobicContact CD-CD1 3.8Å; K45-L267 HydrophobicContact CG-CD1 4.36Å
46	L	92.6	Very high	81	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.5	-179.7	-57.4	172	0	0	0	108.7	F48 L84 V85 V94 L107 I110	L46-F48 HydrophobicContact CB-CD2 4.1Å; L46-F48 HydrophobicContact CB-CE2 3.52Å; L46-F48 HydrophobicContact CB-CZ 4.36Å; L46-F48 HydrophobicContact CD1-CE2 4.06Å; L46-F48 HydrophobicContact CD1-CZ 4.44Å; L46-F48 HydrophobicContact CG-CE2 4.4Å; L46-L84 WeakPolarHBondContact O-CA 3.43Å; L46-V85 PolarHBondContact N-O 3.18Å; L46-V85 PolarHBondContact O-N 2.87Å; L46-V94 HydrophobicContact CD1-CB 4.02Å; L46-V94 HydrophobicContact CD1-CG1 4.31Å; L46-V94 HydrophobicContact CD1-CG2 3.77Å; L46-L107 HydrophobicContact CB-CD1 4.09Å; L46-L107 HydrophobicContact CD2-CD1 4.26Å; L46-I110 HydrophobicContact CD2-CB 4.4Å; L46-I110 HydrophobicContact CD2-CD1 3.61Å; L46-I110 HydrophobicContact CD2-CG1 3.8Å
47	E	92.9	Very high	83.7	Confident	3 Å²	3	56 Å²	56	1%	0.014	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	110.9	176.1	-179	-162.9	154.1	0	0	109.5	L82 L84 K108 G109 L267 F268	E47-L82 HydrophobicContact CG-CD1 3.53Å; E47-L82 HydrophobicContact CG-CD2 4.46Å; E47-L82 HydrophobicContact CG-CG 4.21Å; E47-L82 WeakPolarHBondContact OE1-CD1 3.45Å; E47-L84 HydrophobicContact CB-CD1 4.3Å; E47-K108 HydrophobicContact CG-CB 4.17Å; E47-K108 PolarHBondContact O-N 2.85Å; E47-K108 IonicContact OE1-NZ 2.85Å; E47-K108 PolarHBondContact OE1-NZ 3.04Å; E47-G109 PolarHBondContact N-O 3.46Å; E47-G109 PolarHBondContact O-N 3.15Å; E47-L267 HydrophobicContact CB-CD2 3.78Å; E47-F268 WeakPolarHBondContact OE2-CA 3.37Å; E47-F268 PolarHBondContact OE2-N 3.01Å
48	F	93.1	Very high	86.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.1	173	-68.6	-89.4	0	0	0	110.9	L46 V50 L82 V83 V94 Q95 I98 A105 V106 L107	L46-F48 HydrophobicContact CB-CD2 4.1Å; L46-F48 HydrophobicContact CB-CE2 3.52Å; L46-F48 HydrophobicContact CB-CZ 4.36Å; L46-F48 HydrophobicContact CD1-CE2 4.06Å; L46-F48 HydrophobicContact CD1-CZ 4.44Å; L46-F48 HydrophobicContact CG-CE2 4.4Å; F48-V50 HydrophobicContact CB-CG2 3.78Å; F48-L82 CarbonylContact O-C 3.55Å; F48-L82 WeakPolarHBondContact O-CA 3.42Å; F48-V83 HydrophobicContact CB-CB 4.4Å; F48-V83 PolarHBondContact N-O 2.79Å; F48-V83 PolarHBondContact O-N 2.94Å; F48-V94 HydrophobicContact CD2-CG1 4.29Å; F48-V94 HydrophobicContact CE2-CB 4.07Å; F48-V94 HydrophobicContact CE2-CG1 3.51Å; F48-V94 HydrophobicContact CZ-CB 4.14Å; F48-V94 HydrophobicContact CZ-CG1 4.02Å; F48-Q95 HydrophobicContact CE1-CB 3.78Å; F48-Q95 HydrophobicContact CE1-CG 4.23Å; F48-Q95 HydrophobicContact CZ-CB 4.21Å; F48-I98 HydrophobicContact CB-CD1 4.13Å; F48-I98 HydrophobicContact CD1-CD1 4.28Å; F48-I98 HydrophobicContact CD2-CD1 3.89Å; F48-I98 HydrophobicContact CE2-CD1 4.35Å; F48-I98 HydrophobicContact CG-CD1 3.84Å; F48-A105 HydrophobicContact CD1-CB 4.21Å; F48-V106 CarbonylContact C-O 3.59Å; F48-V106 VanDerWaalsContact CA-O 3.31Å; F48-V106 WeakPolarHBondContact CA-O 3.18Å; F48-L107 HydrophobicContact CD1-CB 4.07Å; F48-L107 HydrophobicContact CD1-CD1 4.32Å; F48-L107 HydrophobicContact CD2-CD1 4.37Å; F48-L107 HydrophobicContact CE1-CB 3.75Å; F48-L107 HydrophobicContact CE1-CD1 3.99Å; F48-L107 HydrophobicContact CE1-CG 4.43Å; F48-L107 HydrophobicContact CE2-CD1 4.06Å; F48-L107 HydrophobicContact CZ-CB 4.4Å; F48-L107 HydrophobicContact CZ-CD1 3.86Å
49	A	91.6	Very high	88.5	Confident	9 Å²	9	51.3 Å²	51.3	7%	0.074	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	127.9	152.7	0	0	0	0	0	108.1	E81 A105 V106 K108 W283	A49-E81 CarbonylContact C-O 3.55Å; A49-E81 WeakPolarHBondContact CA-O 3.35Å; A49-A105 CarbonylContact O-C 3.6Å; A49-A105 WeakPolarHBondContact O-CA 3.28Å; A49-V106 PolarHBondContact N-O 3.12Å; A49-V106 PolarHBondContact O-N 2.82Å; A49-K108 HydrophobicContact CB-CD 3.47Å; A49-K108 VanDerWaalsContact CB-CD 3.47Å; A49-K108 HydrophobicContact CB-CG 3.96Å; A49-W283 VanDerWaalsContact C-CH2 3.43Å; A49-W283 HydrophobicContact CB-CH2 3.75Å; A49-W283 HydrophobicContact CB-CZ2 4.19Å; A49-W283 HydrophobicContact CB-CZ3 4.45Å; A49-W283 WeakPolarHBondContact O-CH2 3.45Å; A49-W283 WeakPolarHBondContact O-CZ3 3.31Å
50	V	91.6	Very high	90	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.2	179.5	-177.5	0	0	0	0	109.8	F48 M52 V61 E81 V83 I98 R103 R104 A105	F48-V50 HydrophobicContact CB-CG2 3.78Å; V50-M52 HydrophobicContact CB-CE 3.54Å; V50-M52 HydrophobicContact CG1-CE 3.61Å; V50-M52 HydrophobicContact CG2-CE 4.43Å; V50-M52 WeakPolarHBondContact O-CG 3.48Å; V50-M52 PolarHBondContact O-N 3.46Å; V50-V61 HydrophobicContact CG1-CG2 4.34Å; V50-E81 PolarHBondContact N-O 2.84Å; V50-E81 WeakPolarHBondContact O-CB 3.39Å; V50-V83 HydrophobicContact CB-CG2 3.88Å; V50-V83 HydrophobicContact CG2-CB 3.89Å; V50-V83 HydrophobicContact CG2-CG2 3.48Å; V50-V83 VanDerWaalsContact CG2-CG2 3.48Å; V50-I98 HydrophobicContact CB-CG2 4.35Å; V50-I98 HydrophobicContact CG1-CG2 3.57Å; V50-I98 HydrophobicContact CG2-CD1 4.14Å; V50-I98 HydrophobicContact CG2-CG2 3.79Å; V50-R103 HydrophobicContact CG1-CB 3.79Å; V50-R103 HydrophobicContact CG1-CG 4.47Å; V50-R104 CarbonylContact C-O 3.57Å; V50-R104 VanDerWaalsContact CA-O 3.3Å; V50-R104 WeakPolarHBondContact CA-O 3.24Å; V50-A105 HydrophobicContact CG2-CB 4.06Å
51	Q	87.3	Confident	91	Very high	93 Å²	93	50.3 Å²	50.3	44%	0.435	25%	0.254	S	S	.	.			trans	-67.2	103.6	-178	-172	-177.5	20.8	0	0	109.7	R103 R104 W283	Q51-R103 WeakPolarHBondContact O-CG 3.12Å; Q51-R104 HydrophobicContact CB-CB 4.33Å; Q51-R104 PolarHBondContact N-O 3.17Å; Q51-W283 HydrophobicContact CB-CH2 4.01Å; Q51-W283 HydrophobicContact CB-CZ2 4.15Å; Q51-W283 HydrophobicContact CB-CZ3 4.23Å
52	M	86.8	Confident	91.7	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.02	23%	0.226	C	C	.	.			trans	-147	132.8	179.8	62.2	175.4	89.8	0	0	111.2	V50 C57 A58 V61 I76 L78 E81 V83	V50-M52 HydrophobicContact CB-CE 3.54Å; V50-M52 HydrophobicContact CG1-CE 3.61Å; V50-M52 HydrophobicContact CG2-CE 4.43Å; V50-M52 WeakPolarHBondContact O-CG 3.48Å; V50-M52 PolarHBondContact O-N 3.46Å; M52-C57 HydrophobicContact CB-CB 3.93Å; M52-A58 HydrophobicContact SD-CB 3.95Å; M52-V61 HydrophobicContact CE-CG2 4.29Å; M52-I76 HydrophobicContact CE-CG2 4.02Å; M52-I76 HydrophobicContact SD-CG2 3.76Å; M52-L78 HydrophobicContact CB-CD1 4.27Å; M52-L78 HydrophobicContact CG-CD1 3.65Å; M52-L78 HydrophobicContact SD-CD1 3.92Å; M52-E81 WeakPolarHBondContact O-CG 2.85Å; M52-V83 HydrophobicContact CE-CG2 3.39Å
53	T	86.8	Confident	92.1	Very high	124 Å²	124	43.3 Å²	43.3	76%	0.761	24%	0.236	S	C	*	.			trans	-118.5	1.8	-175.1	54	0	0	0	0	113
54	C	90.4	Very high	92.5	Very high	40 Å²	40	43.3 Å²	43.3	27%	0.27	24%	0.237	S	C	.	.	S	Bend	trans	-146.5	150.2	-167.8	86.2	0	0	0	0	113.1	S56 C57 A58	C54-S56 VanDerWaalsContact C-N 3.34Å; C54-S56 PolarHBondContact O-N 2.07Å; C54-S56 PolarHBondContact SG-OG 3.5Å; C54-C57 HydrophobicContact CB-CB 4.26Å; C54-C57 WeakPolarHBondContact CB-SG 3.47Å; C54-C57 WeakPolarHBondContact O-CA 3.38Å; C54-C57 WeakPolarHBondContact O-CB 3.39Å; C54-C57 PolarHBondContact O-N 3.05Å; C54-C57 WeakPolarHBondContact SG-CB 3.4Å; C54-C57 PolarHBondContact SG-N 2.83Å; C54-C57 CovalentContact SG-SG 2.07Å; C54-C57 PolarHBondContact SG-SG 2.97Å; C54-A58 PolarHBondContact O-N 3.19Å
55	E	93.3	Very high	92.8	Very high	119 Å²	119	43.3 Å²	43.3	56%	0.556	24%	0.237	S	C	*	.	H	α-helix	trans	-61.9	-41.9	179.6	-163.2	61.5	-147.1	0	0	112	C57 A58 E59 L78	E55-C57 PolarHBondContact O-N 3.07Å; E55-C57 VanDerWaalsContact O-N 3.14Å; E55-A58 WeakPolarHBondContact O-CB 3.47Å; E55-A58 PolarHBondContact O-N 2.8Å; E55-E59 PolarHBondContact O-N 2.95Å; E55-L78 WeakPolarHBondContact OE2-CD2 3.47Å
56	S	93.7	Very high	92.9	Very high	76 Å²	76	45 Å²	45	53%	0.531	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-19	175.5	66.3	0	0	0	0	112.9	C54 K60	C54-S56 VanDerWaalsContact C-N 3.34Å; C54-S56 PolarHBondContact O-N 2.07Å; C54-S56 PolarHBondContact SG-OG 3.5Å; S56-K60 VanDerWaalsContact O-CG 3.31Å; S56-K60 WeakPolarHBondContact O-CG 3.3Å; S56-K60 PolarHBondContact O-N 3.41Å
57	C	92.3	Very high	92.7	Very high	14 Å²	14	49 Å²	49	10%	0.095	29%	0.286	C	S	.	.	H	α-helix	trans	-75.3	-44.3	173.1	-54.1	0	0	0	0	110.3	M52 C54 E55 K60 V61 R103	M52-C57 HydrophobicContact CB-CB 3.93Å; C54-C57 HydrophobicContact CB-CB 4.26Å; C54-C57 WeakPolarHBondContact CB-SG 3.47Å; C54-C57 WeakPolarHBondContact O-CA 3.38Å; C54-C57 WeakPolarHBondContact O-CB 3.39Å; C54-C57 PolarHBondContact O-N 3.05Å; C54-C57 WeakPolarHBondContact SG-CB 3.4Å; C54-C57 PolarHBondContact SG-N 2.83Å; C54-C57 CovalentContact SG-SG 2.07Å; C54-C57 PolarHBondContact SG-SG 2.97Å; E55-C57 PolarHBondContact O-N 3.07Å; E55-C57 VanDerWaalsContact O-N 3.14Å; C57-K60 PolarHBondContact O-N 3.13Å; C57-V61 WeakPolarHBondContact O-CG2 3.13Å; C57-V61 PolarHBondContact O-N 3.18Å; C57-R103 PolarHBondContact SG-NH2 3.13Å
58	A	93.7	Very high	92.8	Very high	3 Å²	3	53.2 Å²	53.2	3%	0.025	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-45.8	175.1	0	0	0	0	0	111.2	M52 C54 E55 K60 V61 R62 I76	M52-A58 HydrophobicContact SD-CB 3.95Å; C54-A58 PolarHBondContact O-N 3.19Å; E55-A58 WeakPolarHBondContact O-CB 3.47Å; E55-A58 PolarHBondContact O-N 2.8Å; A58-K60 VanDerWaalsContact C-N 3.33Å; A58-K60 PolarHBondContact O-N 2.98Å; A58-V61 PolarHBondContact O-N 2.85Å; A58-V61 VanDerWaalsContact O-N 3.11Å; A58-R62 WeakPolarHBondContact O-CB 3.35Å; A58-R62 PolarHBondContact O-N 3.35Å; A58-I76 HydrophobicContact CB-CG2 3.98Å; A58-I76 WeakPolarHBondContact O-CD1 3.4Å
59	E	94.6	Very high	92.7	Very high	94 Å²	94	58.5 Å²	58.5	44%	0.439	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-36	179	-70.9	-56.3	115.7	0	0	113.2	E55 R62 A63	E55-E59 PolarHBondContact O-N 2.95Å; E59-R62 PolarHBondContact O-N 3.26Å; E59-R62 IonicContact OE1-NE 3.56Å; E59-A63 VanDerWaalsContact O-CB 3.31Å; E59-A63 WeakPolarHBondContact O-CB 3.18Å; E59-A63 PolarHBondContact O-N 3.02Å
60	K	95.6	Very high	92.7	Very high	122 Å²	122	59.9 Å²	59.9	53%	0.53	35%	0.354	S	S	.	.	H	α-helix	trans	-64	-41.5	173	-77.8	176.7	179.6	-175.3	0	112.2	S56 C57 A58 A64	S56-K60 VanDerWaalsContact O-CG 3.31Å; S56-K60 WeakPolarHBondContact O-CG 3.3Å; S56-K60 PolarHBondContact O-N 3.41Å; C57-K60 PolarHBondContact O-N 3.13Å; A58-K60 VanDerWaalsContact C-N 3.33Å; A58-K60 PolarHBondContact O-N 2.98Å; K60-A64 WeakPolarHBondContact O-CB 3.42Å; K60-A64 PolarHBondContact O-N 3.02Å; K60-A64 VanDerWaalsContact O-N 3.09Å
61	V	95.8	Very high	92.9	Very high	0 Å²	0	61 Å²	61	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-43.5	176.9	174.6	0	0	0	0	110.5	V50 M52 C57 A58 A63 A64 L65 I76 V83 I98 R103	V50-V61 HydrophobicContact CG1-CG2 4.34Å; M52-V61 HydrophobicContact CE-CG2 4.29Å; C57-V61 WeakPolarHBondContact O-CG2 3.13Å; C57-V61 PolarHBondContact O-N 3.18Å; A58-V61 PolarHBondContact O-N 2.85Å; A58-V61 VanDerWaalsContact O-N 3.11Å; V61-A63 PolarHBondContact O-N 2.97Å; V61-A64 PolarHBondContact O-N 3.34Å; V61-L65 HydrophobicContact CG1-CD1 4Å; V61-L65 PolarHBondContact O-N 3.09Å; V61-I76 HydrophobicContact CB-CD1 4.23Å; V61-I76 HydrophobicContact CG1-CD1 4.16Å; V61-V83 HydrophobicContact CG1-CG1 4.38Å; V61-V83 HydrophobicContact CG1-CG2 4.06Å; V61-I98 HydrophobicContact CG1-CG1 4.25Å; V61-I98 HydrophobicContact CG1-CG2 4.18Å; V61-I98 HydrophobicContact CG2-CG2 4.41Å; V61-R103 HydrophobicContact CG2-CG 4.41Å
62	R	96.4	Very high	93.2	Very high	60 Å²	60	63.1 Å²	63.1	23%	0.226	37%	0.369	C	S	.	.	H	α-helix	trans	-55.7	-52.2	174.3	-174.2	178	-65.1	-73.6	-1.3	111.2	A58 E59 A64 L65 E66 V74 I76	A58-R62 WeakPolarHBondContact O-CB 3.35Å; A58-R62 PolarHBondContact O-N 3.35Å; E59-R62 PolarHBondContact O-N 3.26Å; E59-R62 IonicContact OE1-NE 3.56Å; R62-A64 VanDerWaalsContact C-N 3.25Å; R62-A64 PolarHBondContact O-N 3.08Å; R62-L65 PolarHBondContact O-N 3.29Å; R62-L65 VanDerWaalsContact O-N 3.1Å; R62-E66 VanDerWaalsContact CD-OE1 3.28Å; R62-E66 WeakPolarHBondContact CD-OE1 3.28Å; R62-E66 HydrophobicContact CG-CG 3.86Å; R62-E66 WeakPolarHBondContact CG-OE1 3.06Å; R62-E66 WeakPolarHBondContact CG-OE2 3.38Å; R62-E66 IonicContact CZ-OE1 3.77Å; R62-E66 IonicContact NE-OE1 3.94Å; R62-E66 IonicContact NH1-OE1 2.8Å; R62-E66 PolarHBondContact NH1-OE1 3.01Å; R62-E66 WeakPolarHBondContact O-CB 3.44Å; R62-E66 PolarHBondContact O-N 3.34Å; R62-V74 PolarHBondContact NH1-O 2.86Å; R62-I76 HydrophobicContact CB-CD1 3.85Å
63	A	95.4	Very high	93.6	Very high	75 Å²	75	65.6 Å²	65.6	62%	0.62	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-26.6	180	0	0	0	0	0	113.9	E59 V61 L65	E59-A63 VanDerWaalsContact O-CB 3.31Å; E59-A63 WeakPolarHBondContact O-CB 3.18Å; E59-A63 PolarHBondContact O-N 3.02Å; V61-A63 PolarHBondContact O-N 2.97Å; A63-L65 VanDerWaalsContact C-N 3.34Å
64	A	95.8	Very high	94	Very high	16 Å²	16	60.5 Å²	60.5	13%	0.132	36%	0.355	C	S	.	.	H	α-helix	trans	-74.6	-25.9	176.1	0	0	0	0	0	113.1	K60 V61 R62 K68 T101	K60-A64 WeakPolarHBondContact O-CB 3.42Å; K60-A64 PolarHBondContact O-N 3.02Å; K60-A64 VanDerWaalsContact O-N 3.09Å; V61-A64 PolarHBondContact O-N 3.34Å; R62-A64 VanDerWaalsContact C-N 3.25Å; R62-A64 PolarHBondContact O-N 3.08Å; A64-K68 WeakPolarHBondContact O-CE 3.4Å; A64-K68 WeakPolarHBondContact O-CG 3.1Å; A64-T101 HydrophobicContact CB-CG2 3.45Å; A64-T101 VanDerWaalsContact CB-CG2 3.45Å
65	L	96.1	Very high	94.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-103.1	-44	-174.8	-67.6	170.4	0	0	0	113.1	V61 R62 A63 K68 V74 V83 V85 V94 L97 I98	V61-L65 HydrophobicContact CG1-CD1 4Å; V61-L65 PolarHBondContact O-N 3.09Å; R62-L65 PolarHBondContact O-N 3.29Å; R62-L65 VanDerWaalsContact O-N 3.1Å; A63-L65 VanDerWaalsContact C-N 3.34Å; L65-K68 WeakPolarHBondContact O-CB 3.38Å; L65-K68 WeakPolarHBondContact O-CG 3.43Å; L65-K68 PolarHBondContact O-N 2.75Å; L65-V74 HydrophobicContact CB-CG1 4.4Å; L65-V74 HydrophobicContact CB-CG2 3.69Å; L65-V74 HydrophobicContact CD1-CG1 3.9Å; L65-V74 HydrophobicContact CD1-CG2 4.36Å; L65-V83 HydrophobicContact CD1-CG1 3.93Å; L65-V85 HydrophobicContact CD1-CG2 3.77Å; L65-V94 HydrophobicContact CD2-CG1 4.02Å; L65-L97 HydrophobicContact CD2-CB 3.82Å; L65-L97 HydrophobicContact CD2-CD1 4.15Å; L65-I98 HydrophobicContact CD1-CD1 4.41Å; L65-I98 HydrophobicContact CD1-CG1 3.94Å; L65-I98 HydrophobicContact CD2-CG1 4.13Å; L65-I98 HydrophobicContact CG-CG1 4.31Å
66	E	94.8	Very high	94.4	Very high	94 Å²	94	57.5 Å²	57.5	44%	0.439	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	136.9	-177.4	-74.2	-176.7	179.4	0	0	111.4	R62 K68 V74	R62-E66 VanDerWaalsContact CD-OE1 3.28Å; R62-E66 WeakPolarHBondContact CD-OE1 3.28Å; R62-E66 HydrophobicContact CG-CG 3.86Å; R62-E66 WeakPolarHBondContact CG-OE1 3.06Å; R62-E66 WeakPolarHBondContact CG-OE2 3.38Å; R62-E66 IonicContact CZ-OE1 3.77Å; R62-E66 IonicContact NE-OE1 3.94Å; R62-E66 IonicContact NH1-OE1 2.8Å; R62-E66 PolarHBondContact NH1-OE1 3.01Å; R62-E66 WeakPolarHBondContact O-CB 3.44Å; R62-E66 PolarHBondContact O-N 3.34Å; E66-K68 PolarHBondContact O-N 3.07Å; E66-V74 HydrophobicContact CG-CB 4.13Å; E66-V74 HydrophobicContact CG-CG2 3.98Å
67	G	89.7	Confident	94.4	Very high	82 Å²	82	55.9 Å²	55.9	85%	0.845	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	0.7	-178.1	0	0	0	0	0	114.9
68	K	93.2	Very high	94.3	Very high	92 Å²	92	57.6 Å²	57.6	40%	0.4	34%	0.339	S	S	.	.			trans	-71.7	136.7	171	-66.1	-68.6	-179.5	176.9	0	110.7	A64 L65 E66 G70 V71 L97	A64-K68 WeakPolarHBondContact O-CE 3.4Å; A64-K68 WeakPolarHBondContact O-CG 3.1Å; L65-K68 WeakPolarHBondContact O-CB 3.38Å; L65-K68 WeakPolarHBondContact O-CG 3.43Å; L65-K68 PolarHBondContact O-N 2.75Å; E66-K68 PolarHBondContact O-N 3.07Å; K68-G70 PolarHBondContact O-N 2.95Å; K68-V71 HydrophobicContact CB-CB 4.41Å; K68-V71 HydrophobicContact CB-CG2 3.87Å; K68-V71 PolarHBondContact O-N 3.46Å; K68-V71 VanDerWaalsContact O-N 3.08Å; K68-L97 HydrophobicContact CB-CD1 4.5Å; K68-L97 HydrophobicContact CD-CD2 4.26Å; K68-L97 HydrophobicContact CG-CD1 4.15Å; K68-L97 HydrophobicContact CG-CD2 4.47Å
69	P	92.8	Very high	94.1	Very high	112 Å²	112	62.5 Å²	62.5	73%	0.727	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	134.8	172.4	-24.7	34.1	0	0	0	110.8	V71	P69-V71 VanDerWaalsContact C-N 3.31Å; P69-V71 PolarHBondContact O-N 2.71Å
70	G	91	Very high	93.8	Very high	37 Å²	37	64.3 Å²	64.3	38%	0.381	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-9.6	-178.4	0	0	0	0	0	115.4	K68 A87 A88	K68-G70 PolarHBondContact O-N 2.95Å; G70-A87 CarbonylContact O-C 3.45Å; G70-A87 WeakPolarHBondContact O-CA 3.4Å; G70-A87 WeakPolarHBondContact O-CB 3.34Å; G70-A88 PolarHBondContact O-N 3.26Å
71	V	94.7	Very high	93.6	Very high	23 Å²	23	61.6 Å²	61.6	14%	0.139	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.7	172.6	-179.1	0	0	0	0	109.9	K68 P69 V74 V85 A87 L89	K68-V71 HydrophobicContact CB-CB 4.41Å; K68-V71 HydrophobicContact CB-CG2 3.87Å; K68-V71 PolarHBondContact O-N 3.46Å; K68-V71 VanDerWaalsContact O-N 3.08Å; P69-V71 VanDerWaalsContact C-N 3.31Å; P69-V71 PolarHBondContact O-N 2.71Å; V71-V74 HydrophobicContact CG1-CG2 3.72Å; V71-V85 HydrophobicContact CG1-CG1 3.99Å; V71-A87 HydrophobicContact CG2-CB 4.21Å; V71-L89 HydrophobicContact CG2-CD1 3.72Å
72	K	94.1	Very high	93.4	Very high	139 Å²	139	62.5 Å²	62.5	60%	0.604	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	-45.4	178.7	-72	-163	174.6	173.8	0	113.2	P43 E86	P43-K72 HydrophobicContact CB-CD 4.05Å; P43-K72 HydrophobicContact CG-CD 3.37Å; P43-K72 HydrophobicContact CG-CG 4.24Å; K72-E86 HydrophobicContact CB-CB 4.34Å; K72-E86 HydrophobicContact CB-CG 4.19Å; K72-E86 PolarHBondContact N-O 3.08Å
73	S	94.8	Very high	93.4	Very high	55 Å²	55	59.7 Å²	59.7	39%	0.385	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	149.9	-178	70.6	0	0	0	0	111.8	E86	S73-E86 PolarHBondContact N-O 2.96Å; S73-E86 PolarHBondContact O-N 2.8Å; S73-E86 VanDerWaalsContact OG-CB 3.24Å; S73-E86 WeakPolarHBondContact OG-CB 3.46Å; S73-E86 PolarHBondContact OG-OE2 2.94Å; S73-E86 VanDerWaalsContact OG-OE2 3.13Å
74	V	96.8	Very high	93.4	Very high	18 Å²	18	57.9 Å²	57.9	11%	0.109	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	121.3	178.7	-176	0	0	0	0	109	R62 L65 E66 V71 I76 V83 V85	R62-V74 PolarHBondContact NH1-O 2.86Å; L65-V74 HydrophobicContact CB-CG1 4.4Å; L65-V74 HydrophobicContact CB-CG2 3.69Å; L65-V74 HydrophobicContact CD1-CG1 3.9Å; L65-V74 HydrophobicContact CD1-CG2 4.36Å; E66-V74 HydrophobicContact CG-CB 4.13Å; E66-V74 HydrophobicContact CG-CG2 3.98Å; V71-V74 HydrophobicContact CG1-CG2 3.72Å; V74-I76 HydrophobicContact CG1-CD1 4.39Å; V74-I76 HydrophobicContact CG1-CG1 4.11Å; V74-V83 HydrophobicContact CG1-CG1 4.35Å; V74-V85 HydrophobicContact CG2-CG1 4.48Å
75	S	95.6	Very high	93.3	Very high	69 Å²	69	57.1 Å²	57.1	48%	0.483	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.9	174	-179.9	0	0	0	0	109.3	V83 L84	S75-V83 CarbonylContact O-C 3.58Å; S75-V83 WeakPolarHBondContact O-CA 3.31Å; S75-L84 PolarHBondContact N-O 2.85Å; S75-L84 PolarHBondContact O-N 2.86Å
76	I	95.8	Very high	93.2	Very high	26 Å²	26	59.1 Å²	59.1	13%	0.133	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.3	-178.5	-55.5	-177.3	0	0	0	108.4	M52 A58 V61 R62 V74 L82 V83	M52-I76 HydrophobicContact CE-CG2 4.02Å; M52-I76 HydrophobicContact SD-CG2 3.76Å; A58-I76 HydrophobicContact CB-CG2 3.98Å; A58-I76 WeakPolarHBondContact O-CD1 3.4Å; V61-I76 HydrophobicContact CB-CD1 4.23Å; V61-I76 HydrophobicContact CG1-CD1 4.16Å; R62-I76 HydrophobicContact CB-CD1 3.85Å; V74-I76 HydrophobicContact CG1-CD1 4.39Å; V74-I76 HydrophobicContact CG1-CG1 4.11Å; I76-L82 WeakPolarHBondContact CA-O 3.44Å; I76-V83 HydrophobicContact CG1-CG1 4.26Å; I76-V83 HydrophobicContact CG1-CG2 4.19Å; I76-V83 HydrophobicContact CG2-CG2 4.28Å
77	D	92.7	Very high	93.1	Very high	43 Å²	43	54.7 Å²	54.7	23%	0.23	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	95.6	172	-177	-16.9	0	0	0	108.2	S79 K80 E81 L82	D77-S79 PolarHBondContact O-N 3.22Å; D77-S79 WeakPolarHBondContact OD1-CB 3.45Å; D77-S79 PolarHBondContact OD1-N 3.42Å; D77-S79 VanDerWaalsContact OD1-N 3.11Å; D77-S79 PolarHBondContact OD1-OG 3.14Å; D77-K80 HydrophobicContact CB-CB 4.38Å; D77-K80 CarbonylContact O-C 3.53Å; D77-K80 PolarHBondContact O-N 3.31Å; D77-K80 PolarHBondContact OD1-N 2.82Å; D77-K80 WeakPolarHBondContact OD2-CD 3.4Å; D77-K80 WeakPolarHBondContact OD2-CG 3.3Å; D77-K80 IonicContact OD2-NZ 2.75Å; D77-K80 PolarHBondContact OD2-NZ 3.36Å; D77-E81 PolarHBondContact O-N 3.11Å; D77-L82 HydrophobicContact CB-CB 4.21Å; D77-L82 PolarHBondContact N-O 2.7Å; D77-L82 PolarHBondContact O-N 3.38Å
78	L	91.8	Very high	93.2	Very high	50 Å²	50	51.9 Å²	51.9	26%	0.262	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-61.2	-33.3	-179.2	-179.6	59.6	0	0	0	111.9	M52 E55 K80 E81	M52-L78 HydrophobicContact CB-CD1 4.27Å; M52-L78 HydrophobicContact CG-CD1 3.65Å; M52-L78 HydrophobicContact SD-CD1 3.92Å; E55-L78 WeakPolarHBondContact OE2-CD2 3.47Å; L78-K80 PolarHBondContact O-N 2.81Å; L78-E81 PolarHBondContact O-N 3.07Å
79	S	88.5	Confident	93.1	Very high	106 Å²	106	49 Å²	49	74%	0.741	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-66.9	-27.3	-180	76.2	0	0	0	0	112.7	D77	D77-S79 PolarHBondContact O-N 3.22Å; D77-S79 WeakPolarHBondContact OD1-CB 3.45Å; D77-S79 PolarHBondContact OD1-N 3.42Å; D77-S79 VanDerWaalsContact OD1-N 3.11Å; D77-S79 PolarHBondContact OD1-OG 3.14Å
80	K	88.3	Confident	93.1	Very high	132 Å²	132	44.2 Å²	44.2	57%	0.574	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-104.1	0.7	178.1	-60.6	-165.3	-169.7	99.6	0	113.6	D77 L78 L82	D77-K80 HydrophobicContact CB-CB 4.38Å; D77-K80 CarbonylContact O-C 3.53Å; D77-K80 PolarHBondContact O-N 3.31Å; D77-K80 PolarHBondContact OD1-N 2.82Å; D77-K80 WeakPolarHBondContact OD2-CD 3.4Å; D77-K80 WeakPolarHBondContact OD2-CG 3.3Å; D77-K80 IonicContact OD2-NZ 2.75Å; D77-K80 PolarHBondContact OD2-NZ 3.36Å; L78-K80 PolarHBondContact O-N 2.81Å; K80-L82 HydrophobicContact CB-CB 3.99Å; K80-L82 PolarHBondContact O-N 2.85Å
81	E	91.4	Very high	93	Very high	65 Å²	65	42.9 Å²	42.9	30%	0.304	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	43.3	-172.4	-66.4	-177.4	-148.1	0	0	111.6	A49 V50 M52 D77 L78	A49-E81 CarbonylContact C-O 3.55Å; A49-E81 WeakPolarHBondContact CA-O 3.35Å; V50-E81 PolarHBondContact N-O 2.84Å; V50-E81 WeakPolarHBondContact O-CB 3.39Å; M52-E81 WeakPolarHBondContact O-CG 2.85Å; D77-E81 PolarHBondContact O-N 3.11Å; L78-E81 PolarHBondContact O-N 3.07Å
82	L	92.4	Very high	92.8	Very high	19 Å²	19	43.2 Å²	43.2	10%	0.099	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.6	-168.5	-164.3	79.3	0	0	0	111.5	E47 F48 I76 D77 K80 F268	E47-L82 HydrophobicContact CG-CD1 3.53Å; E47-L82 HydrophobicContact CG-CD2 4.46Å; E47-L82 HydrophobicContact CG-CG 4.21Å; E47-L82 WeakPolarHBondContact OE1-CD1 3.45Å; F48-L82 CarbonylContact O-C 3.55Å; F48-L82 WeakPolarHBondContact O-CA 3.42Å; I76-L82 WeakPolarHBondContact CA-O 3.44Å; D77-L82 HydrophobicContact CB-CB 4.21Å; D77-L82 PolarHBondContact N-O 2.7Å; D77-L82 PolarHBondContact O-N 3.38Å; K80-L82 HydrophobicContact CB-CB 3.99Å; K80-L82 PolarHBondContact O-N 2.85Å; L82-F268 HydrophobicContact CD2-CD1 4.36Å; L82-F268 HydrophobicContact CD2-CE1 3.94Å
83	V	95.3	Very high	92.7	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	116.9	172.4	-177.5	0	0	0	0	108.6	F48 V50 M52 V61 L65 V74 S75 I76 V85 I98	F48-V83 HydrophobicContact CB-CB 4.4Å; F48-V83 PolarHBondContact N-O 2.79Å; F48-V83 PolarHBondContact O-N 2.94Å; V50-V83 HydrophobicContact CB-CG2 3.88Å; V50-V83 HydrophobicContact CG2-CB 3.89Å; V50-V83 HydrophobicContact CG2-CG2 3.48Å; V50-V83 VanDerWaalsContact CG2-CG2 3.48Å; M52-V83 HydrophobicContact CE-CG2 3.39Å; V61-V83 HydrophobicContact CG1-CG1 4.38Å; V61-V83 HydrophobicContact CG1-CG2 4.06Å; L65-V83 HydrophobicContact CD1-CG1 3.93Å; V74-V83 HydrophobicContact CG1-CG1 4.35Å; S75-V83 CarbonylContact O-C 3.58Å; S75-V83 WeakPolarHBondContact O-CA 3.31Å; I76-V83 HydrophobicContact CG1-CG1 4.26Å; I76-V83 HydrophobicContact CG1-CG2 4.19Å; I76-V83 HydrophobicContact CG2-CG2 4.28Å; V83-V85 HydrophobicContact CG1-CG2 3.71Å; V83-I98 HydrophobicContact CG1-CD1 4.45Å
84	L	95	Very high	92.7	Very high	37 Å²	37	38.3 Å²	38.3	19%	0.194	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.1	172.1	-173.4	73.6	0	0	0	108.8	K45 L46 E47 S75 L267 F268	K45-L84 HydrophobicContact CB-CD1 4.31Å; L46-L84 WeakPolarHBondContact O-CA 3.43Å; E47-L84 HydrophobicContact CB-CD1 4.3Å; S75-L84 PolarHBondContact N-O 2.85Å; S75-L84 PolarHBondContact O-N 2.86Å; L84-L267 HydrophobicContact CD1-CD2 3.89Å; L84-F268 HydrophobicContact CD1-CZ 4.26Å; L84-F268 HydrophobicContact CD2-CZ 4.13Å
85	V	95.1	Very high	92.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.7	-179.9	-170.8	0	0	0	0	109.1	K45 L46 L65 V71 V74 V83 A87 V94	K45-V85 CarbonylContact C-O 3.55Å; K45-V85 WeakPolarHBondContact CA-O 3.44Å; L46-V85 PolarHBondContact N-O 3.18Å; L46-V85 PolarHBondContact O-N 2.87Å; L65-V85 HydrophobicContact CD1-CG2 3.77Å; V71-V85 HydrophobicContact CG1-CG1 3.99Å; V74-V85 HydrophobicContact CG2-CG1 4.48Å; V83-V85 HydrophobicContact CG1-CG2 3.71Å; V85-A87 HydrophobicContact CG1-CB 4.03Å; V85-V94 HydrophobicContact CB-CG1 4Å; V85-V94 HydrophobicContact CG1-CG1 3.98Å; V85-V94 HydrophobicContact CG2-CG1 3.84Å
86	E	94.1	Very high	92.4	Very high	43 Å²	43	39.3 Å²	39.3	20%	0.201	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	112.4	167.3	-172.1	-178.2	174.8	0	0	108.9	P43 A44 K45 K72 S73	P43-E86 HydrophobicContact CB-CG 3.69Å; A44-E86 WeakPolarHBondContact O-CA 3.38Å; K45-E86 HydrophobicContact CG-CB 4.31Å; K45-E86 HydrophobicContact CG-CG 4.25Å; K72-E86 HydrophobicContact CB-CB 4.34Å; K72-E86 HydrophobicContact CB-CG 4.19Å; K72-E86 PolarHBondContact N-O 3.08Å; S73-E86 PolarHBondContact N-O 2.96Å; S73-E86 PolarHBondContact O-N 2.8Å; S73-E86 VanDerWaalsContact OG-CB 3.24Å; S73-E86 WeakPolarHBondContact OG-CB 3.46Å; S73-E86 PolarHBondContact OG-OE2 2.94Å; S73-E86 VanDerWaalsContact OG-OE2 3.13Å
87	A	92.6	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	152.4	-174.7	0	0	0	0	0	114.2	P43 A44 G70 V71 V85 L89 V94 R213	P43-A87 WeakPolarHBondContact CA-O 3.49Å; A44-A87 PolarHBondContact N-O 3.08Å; A44-A87 PolarHBondContact O-N 3.17Å; G70-A87 CarbonylContact O-C 3.45Å; G70-A87 WeakPolarHBondContact O-CA 3.4Å; G70-A87 WeakPolarHBondContact O-CB 3.34Å; V71-A87 HydrophobicContact CG2-CB 4.21Å; V85-A87 HydrophobicContact CG1-CB 4.03Å; A87-L89 HydrophobicContact CB-CB 4.29Å; A87-V94 HydrophobicContact CB-CG2 4.15Å; A87-R213 PolarHBondContact O-NH1 2.65Å; A87-R213 PolarHBondContact O-NH2 3.39Å
88	A	92	Very high	92.6	Very high	23 Å²	23	37.7 Å²	37.7	19%	0.19	21%	0.205	C	C	.	.	S	Bend	trans	-85.4	-10.9	166.7	0	0	0	0	0	112.8	E41 G70 R213	E41-A88 WeakPolarHBondContact O-CB 3.39Å; G70-A88 PolarHBondContact O-N 3.26Å; A88-R213 WeakPolarHBondContact O-CD 3.13Å; A88-R213 PolarHBondContact O-NH1 3.05Å
89	L	91.6	Very high	92.7	Very high	33 Å²	33	37.8 Å²	37.8	17%	0.173	20%	0.204	C	C	.	.	S	Bend	trans	-67.4	150.9	174.6	-62.9	175.8	0	0	0	112.2	V71 A87 E93 V94 L97 R213	V71-L89 HydrophobicContact CG2-CD1 3.72Å; A87-L89 HydrophobicContact CB-CB 4.29Å; L89-E93 HydrophobicContact CB-CB 4.23Å; L89-V94 HydrophobicContact CB-CG2 3.76Å; L89-V94 HydrophobicContact CD1-CG2 4.24Å; L89-L97 HydrophobicContact CD1-CD1 3.98Å; L89-R213 PolarHBondContact O-NH1 3.47Å
90	T	91.1	Very high	93	Very high	11 Å²	11	37 Å²	37	7%	0.067	20%	0.199	C	C	.	.			trans	-59.1	153.6	173.3	64.7	0	0	0	0	111.6	T92 E93 V94 D147 R213	T90-T92 PolarHBondContact O-N 2.85Å; T90-E93 WeakPolarHBondContact CB-OE2 3.41Å; T90-E93 WeakPolarHBondContact CG2-OE2 3.12Å; T90-E93 PolarHBondContact N-OE2 2.61Å; T90-E93 PolarHBondContact O-N 2.9Å; T90-E93 VanDerWaalsContact O-N 3.16Å; T90-E93 WeakPolarHBondContact OG1-CB 3.28Å; T90-E93 VanDerWaalsContact OG1-CD 3.29Å; T90-E93 WeakPolarHBondContact OG1-CG 3.44Å; T90-E93 PolarHBondContact OG1-N 3.27Å; T90-E93 VanDerWaalsContact OG1-N 3.13Å; T90-E93 PolarHBondContact OG1-OE2 3.17Å; T90-V94 PolarHBondContact O-N 2.83Å; T90-V94 VanDerWaalsContact O-N 3.13Å; T90-D147 WeakPolarHBondContact CA-OD2 3.22Å; T90-R213 HydrophobicContact CG2-CB 3.84Å
91	S	90.4	Very high	93.3	Very high	9 Å²	9	32 Å²	32	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-54.9	-38.1	175.2	60.6	0	0	0	0	112.8	Q95 D147	S91-Q95 VanDerWaalsContact O-CB 3.28Å; S91-Q95 WeakPolarHBondContact O-CB 3.19Å; S91-Q95 PolarHBondContact O-N 3.45Å; S91-D147 WeakPolarHBondContact CB-OD1 3.37Å; S91-D147 PolarHBondContact N-OD1 3.11Å; S91-D147 PolarHBondContact N-OD2 3.3Å; S91-D147 PolarHBondContact OG-OD1 3.35Å
92	T	89.8	Confident	93.3	Very high	29 Å²	29	32.1 Å²	32.1	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-39.3	177.8	-61.6	0	0	0	0	113	T90 Q95 S96 T149	T90-T92 PolarHBondContact O-N 2.85Å; T92-Q95 PolarHBondContact O-N 3.35Å; T92-S96 WeakPolarHBondContact O-CB 3.47Å; T92-S96 PolarHBondContact O-N 2.97Å; T92-S96 PolarHBondContact O-OG 2.78Å; T92-T149 PolarHBondContact OG1-OG1 2.79Å
93	E	92.9	Very high	93.3	Very high	92 Å²	92	33.4 Å²	33.4	43%	0.43	20%	0.202	S	C	.	.	H	α-helix	trans	-65.9	-45.6	176.1	-75.7	166.4	132.7	0	0	111.5	L89 T90 Q95 S96 L97	L89-E93 HydrophobicContact CB-CB 4.23Å; T90-E93 WeakPolarHBondContact CB-OE2 3.41Å; T90-E93 WeakPolarHBondContact CG2-OE2 3.12Å; T90-E93 PolarHBondContact N-OE2 2.61Å; T90-E93 PolarHBondContact O-N 2.9Å; T90-E93 VanDerWaalsContact O-N 3.16Å; T90-E93 WeakPolarHBondContact OG1-CB 3.28Å; T90-E93 VanDerWaalsContact OG1-CD 3.29Å; T90-E93 WeakPolarHBondContact OG1-CG 3.44Å; T90-E93 PolarHBondContact OG1-N 3.27Å; T90-E93 VanDerWaalsContact OG1-N 3.13Å; T90-E93 PolarHBondContact OG1-OE2 3.17Å; E93-Q95 VanDerWaalsContact C-N 3.32Å; E93-Q95 PolarHBondContact O-N 2.56Å; E93-S96 PolarHBondContact O-N 2.84Å; E93-L97 WeakPolarHBondContact O-CG 3.31Å; E93-L97 PolarHBondContact O-N 2.74Å
94	V	94.4	Very high	92.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-42.7	177.1	-179.9	0	0	0	0	110.6	L46 F48 L65 V85 A87 L89 T90 S96 L97 I98	L46-V94 HydrophobicContact CD1-CB 4.02Å; L46-V94 HydrophobicContact CD1-CG1 4.31Å; L46-V94 HydrophobicContact CD1-CG2 3.77Å; F48-V94 HydrophobicContact CD2-CG1 4.29Å; F48-V94 HydrophobicContact CE2-CB 4.07Å; F48-V94 HydrophobicContact CE2-CG1 3.51Å; F48-V94 HydrophobicContact CZ-CB 4.14Å; F48-V94 HydrophobicContact CZ-CG1 4.02Å; L65-V94 HydrophobicContact CD2-CG1 4.02Å; V85-V94 HydrophobicContact CB-CG1 4Å; V85-V94 HydrophobicContact CG1-CG1 3.98Å; V85-V94 HydrophobicContact CG2-CG1 3.84Å; A87-V94 HydrophobicContact CB-CG2 4.15Å; L89-V94 HydrophobicContact CB-CG2 3.76Å; L89-V94 HydrophobicContact CD1-CG2 4.24Å; T90-V94 PolarHBondContact O-N 2.83Å; T90-V94 VanDerWaalsContact O-N 3.13Å; V94-S96 VanDerWaalsContact C-N 3.33Å; V94-S96 PolarHBondContact O-N 3.37Å; V94-L97 PolarHBondContact O-N 3.42Å; V94-I98 HydrophobicContact CG1-CD1 4.28Å; V94-I98 WeakPolarHBondContact O-CG1 3.4Å; V94-I98 PolarHBondContact O-N 3.21Å; V94-I98 VanDerWaalsContact O-N 3.09Å
95	Q	93.3	Very high	92.7	Very high	42 Å²	42	35.1 Å²	35.1	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-45.9	174.3	-175.2	172.6	-3	0	0	111.6	F48 S91 T92 E93 L97 I98 E99 A105	F48-Q95 HydrophobicContact CE1-CB 3.78Å; F48-Q95 HydrophobicContact CE1-CG 4.23Å; F48-Q95 HydrophobicContact CZ-CB 4.21Å; S91-Q95 VanDerWaalsContact O-CB 3.28Å; S91-Q95 WeakPolarHBondContact O-CB 3.19Å; S91-Q95 PolarHBondContact O-N 3.45Å; T92-Q95 PolarHBondContact O-N 3.35Å; E93-Q95 VanDerWaalsContact C-N 3.32Å; E93-Q95 PolarHBondContact O-N 2.56Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 3.3Å; Q95-I98 PolarHBondContact O-N 3.49Å; Q95-E99 HydrophobicContact CG-CG 4.46Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.48Å; Q95-E99 PolarHBondContact NE2-OE1 3.42Å; Q95-E99 WeakPolarHBondContact O-CB 3.31Å; Q95-E99 WeakPolarHBondContact O-CG 3.44Å; Q95-E99 PolarHBondContact O-N 2.88Å; Q95-A105 HydrophobicContact CG-CB 4.19Å; Q95-A105 PolarHBondContact NE2-O 2.78Å; Q95-A105 VanDerWaalsContact NE2-O 3.17Å
96	S	93.3	Very high	92.4	Very high	65 Å²	65	36.3 Å²	36.3	46%	0.455	21%	0.213	S	C	.	.	H	α-helix	trans	-64.1	-37.9	179.5	-60.5	0	0	0	0	112.3	T92 E93 V94 E99 S100	T92-S96 WeakPolarHBondContact O-CB 3.47Å; T92-S96 PolarHBondContact O-N 2.97Å; T92-S96 PolarHBondContact O-OG 2.78Å; E93-S96 PolarHBondContact O-N 2.84Å; V94-S96 VanDerWaalsContact C-N 3.33Å; V94-S96 PolarHBondContact O-N 3.37Å; S96-E99 PolarHBondContact O-N 3.27Å; S96-S100 WeakPolarHBondContact O-CB 3.37Å; S96-S100 PolarHBondContact O-N 3.1Å
97	L	95.9	Very high	92.1	Very high	35 Å²	35	35 Å²	35	18%	0.183	21%	0.207	C	C	.	.	H	α-helix	trans	-62.1	-44.8	174.1	-73.1	171.3	0	0	0	111.5	L65 K68 L89 E93 V94 Q95 E99 S100	L65-L97 HydrophobicContact CD2-CB 3.82Å; L65-L97 HydrophobicContact CD2-CD1 4.15Å; K68-L97 HydrophobicContact CB-CD1 4.5Å; K68-L97 HydrophobicContact CD-CD2 4.26Å; K68-L97 HydrophobicContact CG-CD1 4.15Å; K68-L97 HydrophobicContact CG-CD2 4.47Å; L89-L97 HydrophobicContact CD1-CD1 3.98Å; E93-L97 WeakPolarHBondContact O-CG 3.31Å; E93-L97 PolarHBondContact O-N 2.74Å; V94-L97 PolarHBondContact O-N 3.42Å; Q95-L97 VanDerWaalsContact C-N 3.34Å; Q95-L97 PolarHBondContact O-N 3.3Å; L97-E99 VanDerWaalsContact C-N 3.35Å; L97-S100 PolarHBondContact O-N 2.83Å; L97-S100 PolarHBondContact O-OG 2.92Å
98	I	95.5	Very high	91.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-45.7	175.1	-62.3	165.4	0	0	0	109.7	F48 V50 V61 L65 V83 V94 Q95 S100 T101 A105	F48-I98 HydrophobicContact CB-CD1 4.13Å; F48-I98 HydrophobicContact CD1-CD1 4.28Å; F48-I98 HydrophobicContact CD2-CD1 3.89Å; F48-I98 HydrophobicContact CE2-CD1 4.35Å; F48-I98 HydrophobicContact CG-CD1 3.84Å; V50-I98 HydrophobicContact CB-CG2 4.35Å; V50-I98 HydrophobicContact CG1-CG2 3.57Å; V50-I98 HydrophobicContact CG2-CD1 4.14Å; V50-I98 HydrophobicContact CG2-CG2 3.79Å; V61-I98 HydrophobicContact CG1-CG1 4.25Å; V61-I98 HydrophobicContact CG1-CG2 4.18Å; V61-I98 HydrophobicContact CG2-CG2 4.41Å; L65-I98 HydrophobicContact CD1-CD1 4.41Å; L65-I98 HydrophobicContact CD1-CG1 3.94Å; L65-I98 HydrophobicContact CD2-CG1 4.13Å; L65-I98 HydrophobicContact CG-CG1 4.31Å; V83-I98 HydrophobicContact CG1-CD1 4.45Å; V94-I98 HydrophobicContact CG1-CD1 4.28Å; V94-I98 WeakPolarHBondContact O-CG1 3.4Å; V94-I98 PolarHBondContact O-N 3.21Å; V94-I98 VanDerWaalsContact O-N 3.09Å; Q95-I98 PolarHBondContact O-N 3.49Å; I98-S100 VanDerWaalsContact C-N 3.29Å; I98-S100 PolarHBondContact O-N 3.09Å; I98-T101 WeakPolarHBondContact O-CB 3.35Å; I98-T101 PolarHBondContact O-N 2.87Å; I98-T101 VanDerWaalsContact O-N 3.15Å; I98-T101 PolarHBondContact O-OG1 2.91Å; I98-A105 HydrophobicContact CB-CB 4.08Å; I98-A105 HydrophobicContact CD1-CB 4.34Å; I98-A105 HydrophobicContact CG2-CB 3.75Å
99	E	94	Very high	91.4	Very high	52 Å²	52	35.6 Å²	35.6	24%	0.243	21%	0.206	C	C	.	.	H	α-helix	trans	-68.7	-25.9	-176.8	-72.8	174.8	-167.8	0	0	114.1	Q95 S96 L97 T101 G102 R103 A105 R286	Q95-E99 HydrophobicContact CG-CG 4.46Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.48Å; Q95-E99 PolarHBondContact NE2-OE1 3.42Å; Q95-E99 WeakPolarHBondContact O-CB 3.31Å; Q95-E99 WeakPolarHBondContact O-CG 3.44Å; Q95-E99 PolarHBondContact O-N 2.88Å; S96-E99 PolarHBondContact O-N 3.27Å; L97-E99 VanDerWaalsContact C-N 3.35Å; E99-T101 PolarHBondContact O-N 2.77Å; E99-G102 WeakPolarHBondContact O-CA 3.4Å; E99-G102 PolarHBondContact O-N 2.92Å; E99-R103 WeakPolarHBondContact CA-O 3.4Å; E99-R103 WeakPolarHBondContact CG-O 3.45Å; E99-A105 HydrophobicContact CG-CB 4.25Å; E99-R286 VanDerWaalsContact CD-NH1 3.35Å; E99-R286 IonicContact OE1-CZ 2.85Å; E99-R286 IonicContact OE1-NH1 3.74Å; E99-R286 PolarHBondContact OE1-NH1 3.2Å; E99-R286 IonicContact OE1-NH2 3.66Å; E99-R286 PolarHBondContact OE1-NH2 3.4Å; E99-R286 IonicContact OE2-CZ 3.27Å; E99-R286 IonicContact OE2-NH1 2.78Å; E99-R286 IonicContact OE2-NH2 2.9Å; E99-R286 PolarHBondContact OE2-NH2 2.89Å
100	S	94.9	Very high	91.2	Very high	90 Å²	90	34.1 Å²	34.1	63%	0.629	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-20.8	172.9	78.5	0	0	0	0	113.2	S96 L97 I98 G102	S96-S100 WeakPolarHBondContact O-CB 3.37Å; S96-S100 PolarHBondContact O-N 3.1Å; L97-S100 PolarHBondContact O-N 2.83Å; L97-S100 PolarHBondContact O-OG 2.92Å; I98-S100 VanDerWaalsContact C-N 3.29Å; I98-S100 PolarHBondContact O-N 3.09Å; S100-G102 PolarHBondContact O-N 3.02Å
101	T	94.3	Very high	90.9	Very high	27 Å²	27	33.6 Å²	33.6	17%	0.166	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-1.5	175.4	70.3	0	0	0	0	113.1	A64 I98 E99 R103	A64-T101 HydrophobicContact CB-CG2 3.45Å; A64-T101 VanDerWaalsContact CB-CG2 3.45Å; I98-T101 WeakPolarHBondContact O-CB 3.35Å; I98-T101 PolarHBondContact O-N 2.87Å; I98-T101 VanDerWaalsContact O-N 3.15Å; I98-T101 PolarHBondContact O-OG1 2.91Å; E99-T101 PolarHBondContact O-N 2.77Å; T101-R103 VanDerWaalsContact C-N 3.35Å; T101-R103 PolarHBondContact O-NH1 2.87Å; T101-R103 WeakPolarHBondContact OG1-CD 3.44Å
102	G	91.9	Very high	90.5	Very high	67 Å²	67	33.3 Å²	33.3	69%	0.691	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	14.1	-175.9	0	0	0	0	0	114.1	E99 S100	E99-G102 WeakPolarHBondContact O-CA 3.4Å; E99-G102 PolarHBondContact O-N 2.92Å; S100-G102 PolarHBondContact O-N 3.02Å
103	R	91.9	Very high	89.4	Confident	46 Å²	46	35.6 Å²	35.6	17%	0.174	21%	0.21	C	C	.	.			trans	-98.9	147.2	173.5	-69.4	91.3	179.8	90.8	12.7	110	V50 Q51 C57 V61 E99 T101	V50-R103 HydrophobicContact CG1-CB 3.79Å; V50-R103 HydrophobicContact CG1-CG 4.47Å; Q51-R103 WeakPolarHBondContact O-CG 3.12Å; C57-R103 PolarHBondContact SG-NH2 3.13Å; V61-R103 HydrophobicContact CG2-CG 4.41Å; E99-R103 WeakPolarHBondContact CA-O 3.4Å; E99-R103 WeakPolarHBondContact CG-O 3.45Å; T101-R103 VanDerWaalsContact C-N 3.35Å; T101-R103 PolarHBondContact O-NH1 2.87Å; T101-R103 WeakPolarHBondContact OG1-CD 3.44Å
104	R	88.1	Confident	88.2	Confident	73 Å²	73	39.5 Å²	39.5	28%	0.275	23%	0.229	S	C	.	.			trans	-81.1	134.4	172.9	-63.8	177.9	68.2	107.4	5.5	109.3	V50 Q51 W283 D287	V50-R104 CarbonylContact C-O 3.57Å; V50-R104 VanDerWaalsContact CA-O 3.3Å; V50-R104 WeakPolarHBondContact CA-O 3.24Å; Q51-R104 HydrophobicContact CB-CB 4.33Å; Q51-R104 PolarHBondContact N-O 3.17Å; R104-W283 HydrophobicContact CB-CE3 4.13Å; R104-W283 HydrophobicContact CB-CZ3 4.24Å; R104-W283 PolarHBondContact NH2-O 3.15Å; R104-W283 WeakPolarHBondContact O-CZ3 3.26Å; R104-D287 IonicContact CZ-OD1 3.75Å; R104-D287 IonicContact CZ-OD2 3.73Å; R104-D287 VanDerWaalsContact CZ-OD2 3.27Å; R104-D287 IonicContact NH1-OD1 3.31Å; R104-D287 IonicContact NH1-OD2 3.71Å; R104-D287 PolarHBondContact NH1-OD2 2.94Å; R104-D287 IonicContact NH2-OD1 3.32Å; R104-D287 PolarHBondContact NH2-OD1 3.27Å; R104-D287 IonicContact NH2-OD2 2.81Å; R104-D287 PolarHBondContact NH2-OD2 3.22Å
105	A	90.7	Very high	87.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.7	175.1	0	0	0	0	0	110.8	F48 A49 V50 Q95 I98 E99 R286	F48-A105 HydrophobicContact CD1-CB 4.21Å; A49-A105 CarbonylContact O-C 3.6Å; A49-A105 WeakPolarHBondContact O-CA 3.28Å; V50-A105 HydrophobicContact CG2-CB 4.06Å; Q95-A105 HydrophobicContact CG-CB 4.19Å; Q95-A105 PolarHBondContact NE2-O 2.78Å; Q95-A105 VanDerWaalsContact NE2-O 3.17Å; I98-A105 HydrophobicContact CB-CB 4.08Å; I98-A105 HydrophobicContact CD1-CB 4.34Å; I98-A105 HydrophobicContact CG2-CB 3.75Å; E99-A105 HydrophobicContact CG-CB 4.25Å; A105-R286 PolarHBondContact O-NH1 3.26Å
106	V	88.1	Confident	86.2	Confident	25 Å²	25	47.6 Å²	47.6	15%	0.152	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	124	174.5	178.9	0	0	0	0	108.2	F48 A49 K108 W283	F48-V106 CarbonylContact C-O 3.59Å; F48-V106 VanDerWaalsContact CA-O 3.31Å; F48-V106 WeakPolarHBondContact CA-O 3.18Å; A49-V106 PolarHBondContact N-O 3.12Å; A49-V106 PolarHBondContact O-N 2.82Å; V106-K108 PolarHBondContact O-N 3.01Å; V106-W283 HydrophobicContact CB-CZ3 4.47Å; V106-W283 HydrophobicContact CG2-CE3 3.82Å; V106-W283 HydrophobicContact CG2-CZ3 3.92Å
107	L	87.8	Confident	85.8	Confident	16 Å²	16	47.3 Å²	47.3	8%	0.084	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	120	174.4	-177.8	67.2	0	0	0	109.9	L46 F48 G109 R135	L46-L107 HydrophobicContact CB-CD1 4.09Å; L46-L107 HydrophobicContact CD2-CD1 4.26Å; F48-L107 HydrophobicContact CD1-CB 4.07Å; F48-L107 HydrophobicContact CD1-CD1 4.32Å; F48-L107 HydrophobicContact CD2-CD1 4.37Å; F48-L107 HydrophobicContact CE1-CB 3.75Å; F48-L107 HydrophobicContact CE1-CD1 3.99Å; F48-L107 HydrophobicContact CE1-CG 4.43Å; F48-L107 HydrophobicContact CE2-CD1 4.06Å; F48-L107 HydrophobicContact CZ-CB 4.4Å; F48-L107 HydrophobicContact CZ-CD1 3.86Å; L107-G109 WeakPolarHBondContact CD1-O 3.17Å; L107-R135 VanDerWaalsContact CD2-NE 3.31Å
108	K	85.3	Confident	85.6	Confident	34 Å²	34	46.8 Å²	46.8	15%	0.148	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-31.5	-178.3	-73.8	-169.1	63.9	-129.7	0	113.9	E47 A49 V106 N270 L282	E47-K108 HydrophobicContact CG-CB 4.17Å; E47-K108 PolarHBondContact O-N 2.85Å; E47-K108 IonicContact OE1-NZ 2.85Å; E47-K108 PolarHBondContact OE1-NZ 3.04Å; A49-K108 HydrophobicContact CB-CD 3.47Å; A49-K108 VanDerWaalsContact CB-CD 3.47Å; A49-K108 HydrophobicContact CB-CG 3.96Å; V106-K108 PolarHBondContact O-N 3.01Å; K108-N270 WeakPolarHBondContact CE-O 3.49Å; K108-N270 PolarHBondContact NZ-O 3.02Å; K108-L282 HydrophobicContact CD-CD1 4.31Å
109	G	84.9	Confident	85.4	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	154.4	-175.2	0	0	0	0	0	111.7	E47 L107	E47-G109 PolarHBondContact N-O 3.46Å; E47-G109 PolarHBondContact O-N 3.15Å; L107-G109 WeakPolarHBondContact CD1-O 3.17Å
110	I	86.6	Confident	85.5	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	140.4	173.4	-171.8	161.3	0	0	0	107.6	A44 K45 L46 A119 L137	A44-I110 HydrophobicContact CB-CG1 4.45Å; K45-I110 WeakPolarHBondContact O-CA 3.33Å; L46-I110 HydrophobicContact CD2-CB 4.4Å; L46-I110 HydrophobicContact CD2-CD1 3.61Å; L46-I110 HydrophobicContact CD2-CG1 3.8Å; I110-A119 HydrophobicContact CG2-CB 4.48Å; I110-L137 HydrophobicContact CD1-CB 4.5Å; I110-L137 HydrophobicContact CD1-CD2 4.49Å; I110-L137 HydrophobicContact CG1-CB 4.33Å; I110-L137 HydrophobicContact CG1-CD2 3.83Å; I110-L137 HydrophobicContact CG2-CB 4.31Å
111	G	85.8	Confident	85.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	162	-179.5	0	0	0	0	0	113.8	K45 L137	K45-G111 PolarHBondContact N-O 2.88Å; K45-G111 PolarHBondContact O-N 3.34Å; G111-L137 WeakPolarHBondContact O-CD2 3.46Å
112	G	80.5	Confident	85.6	Confident	4 Å²	4	40.5 Å²	40.5	4%	0.041	23%	0.227	C	C	.	.			trans	-79.4	174.4	178.3	0	0	0	0	0	113.2
113	S	67.3	Low	85.8	Confident	76 Å²	76	42.3 Å²	42.3	53%	0.531	22%	0.219	S	C	.	.	S	Bend	trans	-70.7	-32.2	174.6	48.2	0	0	0	0	112.9	K45	K45-S113 PolarHBondContact NZ-O 3.12Å; K45-S113 VanDerWaalsContact NZ-O 3.17Å
114	E	68.6	Low	85.9	Confident	174 Å²	174	40.4 Å²	40.4	81%	0.813	21%	0.212	S	C	*	.	S	Bend	trans	-101.6	-73.6	-171.8	-59.7	-170.1	179.6	0	0	113.6
115	Q	70.6	Confident	86.2	Confident	141 Å²	141	40.8 Å²	40.8	66%	0.659	23%	0.226	S	C	*	.			trans	-138.1	146.1	-174.4	-69.2	172.7	7.2	0	0	110.7	L117	Q115-L117 PolarHBondContact O-N 3.31Å
116	D	73.4	Confident	85.9	Confident	71 Å²	71	42 Å²	42	38%	0.38	24%	0.238	S	C	.	.			trans	-75.2	90	174.6	-73.4	-20.7	0	0	0	109.7	G118 Q269	D116-G118 VanDerWaalsContact C-N 3.3Å; D116-Q269 PolarHBondContact OD2-NE2 2.86Å; D116-Q269 VanDerWaalsContact OD2-NE2 3.08Å
117	L	86.1	Confident	85.4	Confident	60 Å²	60	44.3 Å²	44.3	31%	0.314	26%	0.26	S	S	.	.			trans	-80.8	-10.6	179.7	-65	175.1	0	0	0	113.6	Q115 Q138 S140	Q115-L117 PolarHBondContact O-N 3.31Å; L117-Q138 HydrophobicContact CB-CB 3.81Å; L117-Q138 HydrophobicContact CB-CG 3.83Å; L117-Q138 HydrophobicContact CD1-CG 4.46Å; L117-S140 VanDerWaalsContact CD1-C 3.43Å; L117-S140 VanDerWaalsContact CD1-CA 3.44Å
118	G	90.2	Very high	85.1	Confident	23 Å²	23	47.6 Å²	47.6	24%	0.237	30%	0.298	C	S	.	.			trans	149.2	139.2	174.6	0	0	0	0	0	112	D116 Q138	D116-G118 VanDerWaalsContact C-N 3.3Å; G118-Q138 PolarHBondContact O-N 2.88Å
119	A	92.9	Very high	85.2	Confident	12 Å²	12	50.1 Å²	50.1	10%	0.099	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.8	172.9	0	0	0	0	0	110.1	I110 F136 S264	I110-A119 HydrophobicContact CG2-CB 4.48Å; A119-F136 WeakPolarHBondContact CA-O 3.27Å; A119-S264 PolarHBondContact O-N 3.23Å
120	A	95.4	Very high	85.5	Confident	0 Å²	0	51 Å²	51	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	163.6	175	0	0	0	0	0	111.3	R135 F136 V221 I225 I261 A262	A120-R135 WeakPolarHBondContact O-CA 3.36Å; A120-F136 HydrophobicContact CB-CB 4.18Å; A120-F136 HydrophobicContact CB-CD2 4.36Å; A120-F136 PolarHBondContact N-O 3.23Å; A120-F136 PolarHBondContact O-N 3.09Å; A120-V221 HydrophobicContact CB-CG1 3.82Å; A120-I225 HydrophobicContact CB-CG1 4.26Å; A120-I261 HydrophobicContact CB-CG2 3.7Å; A120-A262 CarbonylContact C-O 3.59Å; A120-A262 WeakPolarHBondContact CA-O 3.45Å; A120-A262 WeakPolarHBondContact CB-O 3.33Å
121	V	95.4	Very high	85.9	Confident	25 Å²	25	55.7 Å²	55.7	15%	0.152	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	136.4	178.4	63.3	0	0	0	0	109.6	V133 V134 R135 A262	V121-V133 HydrophobicContact CG2-CG1 3.68Å; V121-V134 CarbonylContact C-O 3.59Å; V121-V134 WeakPolarHBondContact CA-O 3.28Å; V121-R135 HydrophobicContact CG2-CG 4.11Å; V121-A262 PolarHBondContact N-O 3.13Å; V121-A262 PolarHBondContact O-N 3.33Å
122	A	96.6	Very high	86.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.4	167.7	0	0	0	0	0	108.6	V134 F136 L229 I261	A122-V134 PolarHBondContact N-O 3.45Å; A122-V134 PolarHBondContact O-N 2.93Å; A122-F136 HydrophobicContact CB-CE2 4.18Å; A122-L229 HydrophobicContact CB-CB 3.88Å; A122-L229 HydrophobicContact CB-CD2 4.02Å; A122-I261 HydrophobicContact CB-CG1 4.09Å
123	M	95.8	Very high	86.8	Confident	106 Å²	106	58.5 Å²	58.5	52%	0.522	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.6	168.4	-65.3	-177.7	70.4	0	0	107.6	G132 G259 V290	M123-G132 CarbonylContact C-O 3.57Å; M123-G132 WeakPolarHBondContact CA-O 3.35Å; M123-G259 VanDerWaalsContact O-CA 3.25Å; M123-G259 WeakPolarHBondContact O-CA 3.5Å; M123-V290 HydrophobicContact CE-CG1 3.62Å; M123-V290 HydrophobicContact CE-CG2 4.36Å
124	L	93.5	Very high	88.1	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.6	179.2	-58.2	-178.5	0	0	0	109.3	Q131 G132 V134 I150 L229 V231 A257	L124-Q131 WeakPolarHBondContact O-CA 3.35Å; L124-G132 PolarHBondContact N-O 3.31Å; L124-G132 PolarHBondContact O-N 3.22Å; L124-V134 HydrophobicContact CD1-CG2 4.01Å; L124-V134 HydrophobicContact CG-CG2 4.5Å; L124-I150 HydrophobicContact CD1-CD1 3.56Å; L124-I150 HydrophobicContact CD1-CG1 3.94Å; L124-L229 HydrophobicContact CD1-CD2 4.28Å; L124-L229 HydrophobicContact CD2-CB 4.02Å; L124-L229 HydrophobicContact CD2-CD2 4.11Å; L124-L229 HydrophobicContact CD2-CG 4.13Å; L124-L229 VanDerWaalsContact CD2-O 3.3Å; L124-L229 WeakPolarHBondContact CD2-O 3.03Å; L124-L229 HydrophobicContact CG-CD2 4.49Å; L124-V231 HydrophobicContact CD1-CG1 4.25Å; L124-A257 HydrophobicContact CB-CB 4.34Å
125	S	93.6	Very high	89.4	Confident	80 Å²	80	49 Å²	49	56%	0.559	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	136	169.7	-172.7	0	0	0	0	108	C258	S125-C258 PolarHBondContact N-O 3.07Å; S125-C258 PolarHBondContact O-N 3.45Å; S125-C258 VanDerWaalsContact O-N 3.14Å
126	G	85.8	Confident	90.6	Very high	25 Å²	25	42.3 Å²	42.3	26%	0.258	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	-166.5	-175.3	0	0	0	0	0	113.4	I130 L256	G126-I130 PolarHBondContact N-O 3.47Å; G126-L256 WeakPolarHBondContact CA-O 3.48Å
127	A	77.3	Confident	91.5	Very high	74 Å²	74	39 Å²	39	61%	0.612	26%	0.261	S	S	*	.	S	Bend	trans	-61.7	143.2	175.9	0	0	0	0	0	111.4	S129 L256	A127-S129 PolarHBondContact O-N 2.88Å; A127-L256 PolarHBondContact N-O 3.4Å; A127-L256 VanDerWaalsContact N-O 3.16Å
128	G	81.9	Confident	91.9	Very high	86 Å²	86	36.2 Å²	36.2	89%	0.887	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	-124.8	176.7	0	0	0	0	0	113.3
129	S	86.4	Confident	91.9	Very high	87 Å²	87	36.1 Å²	36.1	61%	0.608	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	8.7	-176.8	55	0	0	0	0	113.7	A127 Q131	A127-S129 PolarHBondContact O-N 2.88Å; S129-Q131 PolarHBondContact O-N 3.48Å
130	I	92.3	Very high	91.8	Very high	18 Å²	18	37.2 Å²	37.2	9%	0.092	25%	0.247	C	C	.	.			trans	-73.3	120.5	-175.9	-56.2	171.6	0	0	0	109.7	G126 I150 D151 G152 L153 L256 A257	G126-I130 PolarHBondContact N-O 3.47Å; I130-I150 HydrophobicContact CG2-CG2 4.16Å; I130-D151 WeakPolarHBondContact CA-O 3.4Å; I130-G152 WeakPolarHBondContact CG1-O 3.48Å; I130-L153 HydrophobicContact CD1-CD2 4.35Å; I130-L153 HydrophobicContact CG2-CD2 4.02Å; I130-L256 HydrophobicContact CD1-CB 3.75Å; I130-L256 HydrophobicContact CD1-CD1 3.8Å; I130-L256 HydrophobicContact CD1-CD2 4.28Å; I130-L256 HydrophobicContact CD1-CG 4.17Å; I130-A257 HydrophobicContact CB-CB 4.29Å; I130-A257 HydrophobicContact CG2-CB 3.6Å
131	Q	93.9	Very high	91.5	Very high	101 Å²	101	44 Å²	44	47%	0.472	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	148.4	178.9	61.1	-173.1	-24.7	0	0	110.2	L124 S129 D151	L124-Q131 WeakPolarHBondContact O-CA 3.35Å; S129-Q131 PolarHBondContact O-N 3.48Å; Q131-D151 HydrophobicContact CG-CB 4.42Å; Q131-D151 PolarHBondContact N-O 2.95Å; Q131-D151 VanDerWaalsContact N-O 3.17Å; Q131-D151 PolarHBondContact O-N 2.65Å
132	G	91.3	Very high	91.2	Very high	10 Å²	10	47.8 Å²	47.8	10%	0.103	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	164.2	179.1	0	0	0	0	0	113.1	M123 L124 T149	M123-G132 CarbonylContact C-O 3.57Å; M123-G132 WeakPolarHBondContact CA-O 3.35Å; L124-G132 PolarHBondContact N-O 3.31Å; L124-G132 PolarHBondContact O-N 3.22Å; G132-T149 CarbonylContact C-O 3.5Å; G132-T149 WeakPolarHBondContact CA-O 3.47Å
133	V	94	Very high	91	Very high	54 Å²	54	48.6 Å²	48.6	33%	0.327	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.7	172	-179.2	0	0	0	0	107.4	V121 R135 G148 T149	V121-V133 HydrophobicContact CG2-CG1 3.68Å; V133-R135 HydrophobicContact CG1-CG 4.31Å; V133-G148 VanDerWaalsContact O-CA 3.31Å; V133-G148 WeakPolarHBondContact O-CA 3.16Å; V133-T149 PolarHBondContact N-O 2.87Å; V133-T149 PolarHBondContact O-N 2.98Å
134	V	95.6	Very high	91	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.3	176.1	-174.3	0	0	0	0	108.6	V121 A122 L124 F136 I146 I150 F212 L229	V121-V134 CarbonylContact C-O 3.59Å; V121-V134 WeakPolarHBondContact CA-O 3.28Å; A122-V134 PolarHBondContact N-O 3.45Å; A122-V134 PolarHBondContact O-N 2.93Å; L124-V134 HydrophobicContact CD1-CG2 4.01Å; L124-V134 HydrophobicContact CG-CG2 4.5Å; V134-F136 HydrophobicContact CG1-CE2 4.15Å; V134-F136 HydrophobicContact CG1-CZ 4.15Å; V134-I146 HydrophobicContact CG1-CG2 3.7Å; V134-I150 HydrophobicContact CG2-CG1 4.46Å; V134-F212 HydrophobicContact CG1-CE2 4.16Å; V134-F212 HydrophobicContact CG1-CZ 4.36Å; V134-F212 HydrophobicContact CG2-CE2 4.46Å; V134-F212 HydrophobicContact CG2-CZ 3.84Å; V134-L229 HydrophobicContact CB-CD2 3.46Å; V134-L229 VanDerWaalsContact CB-CD2 3.46Å; V134-L229 HydrophobicContact CG1-CD2 3.66Å; V134-L229 HydrophobicContact CG2-CD2 3.56Å
135	R	94.8	Very high	91	Very high	51 Å²	51	43.3 Å²	43.3	19%	0.192	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.4	-174.9	-62.8	177.2	-178	-85.5	5.2	109.1	L107 A120 V121 V133 I146 D147	L107-R135 VanDerWaalsContact CD2-NE 3.31Å; A120-R135 WeakPolarHBondContact O-CA 3.36Å; V121-R135 HydrophobicContact CG2-CG 4.11Å; V133-R135 HydrophobicContact CG1-CG 4.31Å; R135-I146 WeakPolarHBondContact O-CA 3.36Å; R135-D147 PolarHBondContact N-O 3.33Å; R135-D147 PolarHBondContact O-N 3.25Å
136	F	95.6	Very high	91.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.5	177.5	-56.1	-99.2	0	0	0	108	A119 A120 A122 V134 L145 I146 L219 V221 L229 I261	A119-F136 WeakPolarHBondContact CA-O 3.27Å; A120-F136 HydrophobicContact CB-CB 4.18Å; A120-F136 HydrophobicContact CB-CD2 4.36Å; A120-F136 PolarHBondContact N-O 3.23Å; A120-F136 PolarHBondContact O-N 3.09Å; A122-F136 HydrophobicContact CB-CE2 4.18Å; V134-F136 HydrophobicContact CG1-CE2 4.15Å; V134-F136 HydrophobicContact CG1-CZ 4.15Å; F136-L145 CarbonylContact C-O 3.46Å; F136-L145 WeakPolarHBondContact CA-O 3.44Å; F136-I146 HydrophobicContact CD1-CG1 3.77Å; F136-I146 HydrophobicContact CE1-CD1 4.43Å; F136-I146 HydrophobicContact CE1-CG1 3.94Å; F136-I146 HydrophobicContact CE1-CG2 4.28Å; F136-L219 HydrophobicContact CD1-CD2 3.86Å; F136-L219 HydrophobicContact CE1-CD2 3.74Å; F136-V221 HydrophobicContact CB-CG2 3.94Å; F136-L229 HydrophobicContact CE2-CD2 4.36Å; F136-L229 HydrophobicContact CZ-CD1 4.19Å; F136-L229 HydrophobicContact CZ-CD2 4Å; F136-I261 HydrophobicContact CD2-CG2 4.13Å; F136-I261 HydrophobicContact CE2-CD1 4.34Å; F136-I261 HydrophobicContact CE2-CG1 4.1Å; F136-I261 HydrophobicContact CE2-CG2 4.15Å; F136-I261 HydrophobicContact CZ-CD1 4.14Å; F136-I261 HydrophobicContact CZ-CG1 4.35Å
137	L	93.9	Very high	91.6	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	121.3	173.7	171.8	67.8	0	0	0	108.7	A44 I110 G111 L139 L145	A44-L137 HydrophobicContact CB-CD2 4.07Å; I110-L137 HydrophobicContact CD1-CB 4.5Å; I110-L137 HydrophobicContact CD1-CD2 4.49Å; I110-L137 HydrophobicContact CG1-CB 4.33Å; I110-L137 HydrophobicContact CG1-CD2 3.83Å; I110-L137 HydrophobicContact CG2-CB 4.31Å; G111-L137 WeakPolarHBondContact O-CD2 3.46Å; L137-L139 HydrophobicContact CD2-CD2 3.53Å; L137-L139 HydrophobicContact CD2-CG 4.46Å; L137-L139 HydrophobicContact CG-CD2 4.07Å; L137-L139 PolarHBondContact O-N 2.78Å; L137-L145 HydrophobicContact CB-CB 4.29Å; L137-L145 HydrophobicContact CD2-CD2 4.43Å; L137-L145 PolarHBondContact N-O 2.85Å; L137-L145 PolarHBondContact O-N 2.82Å
138	Q	93.9	Very high	92.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	108.8	171.1	-162.8	77.3	37.3	0	0	109.1	L117 G118 S140 D143 V221 W222	L117-Q138 HydrophobicContact CB-CB 3.81Å; L117-Q138 HydrophobicContact CB-CG 3.83Å; L117-Q138 HydrophobicContact CD1-CG 4.46Å; G118-Q138 PolarHBondContact O-N 2.88Å; Q138-S140 WeakPolarHBondContact CG-O 3.33Å; Q138-S140 PolarHBondContact NE2-O 3.13Å; Q138-D143 PolarHBondContact NE2-O 2.77Å; Q138-V221 HydrophobicContact CB-CB 4.31Å; Q138-V221 HydrophobicContact CB-CG2 3.89Å; Q138-W222 HydrophobicContact CB-CZ3 4.37Å; Q138-W222 HydrophobicContact CG-CE3 4.49Å; Q138-W222 HydrophobicContact CG-CH2 3.91Å; Q138-W222 HydrophobicContact CG-CZ3 3.58Å
139	L	89.7	Confident	92.8	Very high	22 Å²	22	31.6 Å²	31.6	12%	0.115	17%	0.168	C	C	.	.			trans	-83	-38.3	-178.2	-68.2	174.8	0	0	0	112	R42 L137 D143 L145 E215	R42-L139 HydrophobicContact CG-CD1 4.41Å; L137-L139 HydrophobicContact CD2-CD2 3.53Å; L137-L139 HydrophobicContact CD2-CG 4.46Å; L137-L139 HydrophobicContact CG-CD2 4.07Å; L137-L139 PolarHBondContact O-N 2.78Å; L139-D143 HydrophobicContact CB-CB 4.42Å; L139-D143 PolarHBondContact N-O 2.85Å; L139-L145 HydrophobicContact CD1-CB 3.7Å; L139-L145 HydrophobicContact CD2-CB 4.46Å; L139-L145 HydrophobicContact CG-CB 3.87Å; L139-E215 HydrophobicContact CD1-CG 4.32Å
140	S	90.1	Very high	93.2	Very high	35 Å²	35	27.4 Å²	27.4	25%	0.245	14%	0.139	C	C	.	.	S	Bend	trans	-144.9	171.8	175.9	74.5	0	0	0	0	108.6	L117 Q138 E142 D143	L117-S140 VanDerWaalsContact CD1-C 3.43Å; L117-S140 VanDerWaalsContact CD1-CA 3.44Å; Q138-S140 WeakPolarHBondContact CG-O 3.33Å; Q138-S140 PolarHBondContact NE2-O 3.13Å; S140-E142 PolarHBondContact O-N 3.19Å; S140-E142 PolarHBondContact OG-N 3.42Å; S140-E142 VanDerWaalsContact OG-N 3.12Å; S140-D143 PolarHBondContact N-O 2.67Å; S140-D143 PolarHBondContact O-N 3.3Å; S140-D143 WeakPolarHBondContact OG-CB 3.41Å; S140-D143 PolarHBondContact OG-N 3.31Å; S140-D143 PolarHBondContact OG-OD2 2.88Å
141	E	89.3	Confident	93.3	Very high	141 Å²	141	28.7 Å²	28.7	66%	0.659	15%	0.146	S	C	*	.	S	Bend	trans	-55.5	-26.4	170.8	-71	-172.7	177.5	0	0	112	K220	E141-K220 WeakPolarHBondContact O-CD 3.49Å; E141-K220 WeakPolarHBondContact O-CE 3.38Å; E141-K220 PolarHBondContact O-NZ 2.9Å
142	E	90.4	Very high	93.2	Very high	105 Å²	105	25.5 Å²	25.5	49%	0.491	14%	0.14	S	C	.	.	S	Bend	trans	-95.5	-27.8	-177.8	-62.6	-55.5	163.9	0	0	115.2	S140 R217 K220	S140-E142 PolarHBondContact O-N 3.19Å; S140-E142 PolarHBondContact OG-N 3.42Å; S140-E142 VanDerWaalsContact OG-N 3.12Å; E142-R217 CarbonylContact O-C 3.36Å; E142-R217 WeakPolarHBondContact O-CA 3.36Å; E142-K220 PolarHBondContact O-NZ 2.98Å; E142-K220 VanDerWaalsContact O-NZ 3.11Å; E142-K220 IonicContact OE2-NZ 3.66Å; E142-K220 PolarHBondContact OE2-NZ 3.07Å; E142-K220 VanDerWaalsContact OE2-NZ 3.09Å
143	D	92.1	Very high	93.4	Very high	17 Å²	17	25.5 Å²	25.5	9%	0.091	14%	0.138	C	C	.	.			trans	-119	123.7	-168.7	-52.7	-58.1	0	0	0	111.9	R42 Q138 L139 S140 R217	R42-D143 IonicContact CZ-OD2 2.72Å; R42-D143 IonicContact NH1-OD2 3.94Å; R42-D143 PolarHBondContact NH1-OD2 2.9Å; R42-D143 IonicContact NH2-OD2 3.62Å; Q138-D143 PolarHBondContact NE2-O 2.77Å; L139-D143 HydrophobicContact CB-CB 4.42Å; L139-D143 PolarHBondContact N-O 2.85Å; S140-D143 PolarHBondContact N-O 2.67Å; S140-D143 PolarHBondContact O-N 3.3Å; S140-D143 WeakPolarHBondContact OG-CB 3.41Å; S140-D143 PolarHBondContact OG-N 3.31Å; S140-D143 PolarHBondContact OG-OD2 2.88Å; D143-R217 IonicContact OD1-NE 2.61Å
144	C	94.9	Very high	93.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119	171.1	-179.7	0	0	0	0	109.8	E215 D216 L219	C144-E215 CarbonylContact O-C 3.58Å; C144-E215 WeakPolarHBondContact O-CA 3.15Å; C144-D216 PolarHBondContact N-O 2.92Å; C144-D216 PolarHBondContact O-N 3.18Å; C144-L219 WeakPolarHBondContact CB-O 2.98Å
145	L	94.9	Very high	93.6	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	134.5	170.5	-178.7	68.2	0	0	0	110.3	T40 A44 F136 L137 L139 R213 E215	T40-L145 HydrophobicContact CG2-CD1 3.55Å; A44-L145 HydrophobicContact CB-CD2 3.72Å; F136-L145 CarbonylContact C-O 3.46Å; F136-L145 WeakPolarHBondContact CA-O 3.44Å; L137-L145 HydrophobicContact CB-CB 4.29Å; L137-L145 HydrophobicContact CD2-CD2 4.43Å; L137-L145 PolarHBondContact N-O 2.85Å; L137-L145 PolarHBondContact O-N 2.82Å; L139-L145 HydrophobicContact CD1-CB 3.7Å; L139-L145 HydrophobicContact CD2-CB 4.46Å; L139-L145 HydrophobicContact CG-CB 3.87Å; L145-R213 HydrophobicContact CD1-CG 3.84Å; L145-E215 HydrophobicContact CD1-CG 4.04Å
146	I	96.1	Very high	93.7	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120	175.5	-58.9	155.4	0	0	0	106.9	V134 R135 F136 L199 F212 R213 F214 D216 L219	V134-I146 HydrophobicContact CG1-CG2 3.7Å; R135-I146 WeakPolarHBondContact O-CA 3.36Å; F136-I146 HydrophobicContact CD1-CG1 3.77Å; F136-I146 HydrophobicContact CE1-CD1 4.43Å; F136-I146 HydrophobicContact CE1-CG1 3.94Å; F136-I146 HydrophobicContact CE1-CG2 4.28Å; I146-L199 HydrophobicContact CD1-CD1 4.21Å; I146-L199 HydrophobicContact CD1-CD2 3.87Å; I146-F212 HydrophobicContact CG2-CE2 4.21Å; I146-R213 CarbonylContact O-C 3.53Å; I146-R213 VanDerWaalsContact O-CA 3.26Å; I146-R213 WeakPolarHBondContact O-CA 3.34Å; I146-F214 HydrophobicContact CB-CD2 4.3Å; I146-F214 HydrophobicContact CB-CE2 4.06Å; I146-F214 HydrophobicContact CB-CZ 4.23Å; I146-F214 HydrophobicContact CD1-CD2 3.98Å; I146-F214 HydrophobicContact CD1-CE2 3.41Å; I146-F214 VanDerWaalsContact CD1-CE2 3.41Å; I146-F214 HydrophobicContact CD1-CZ 4.11Å; I146-F214 HydrophobicContact CG1-CE2 4.34Å; I146-F214 HydrophobicContact CG2-CE1 4.34Å; I146-F214 HydrophobicContact CG2-CE2 4.31Å; I146-F214 HydrophobicContact CG2-CZ 3.99Å; I146-F214 PolarHBondContact N-O 2.94Å; I146-F214 PolarHBondContact O-N 3.25Å; I146-D216 HydrophobicContact CD1-CB 3.94Å; I146-L219 HydrophobicContact CD1-CD2 3.94Å; I146-L219 HydrophobicContact CG1-CD2 4.43Å
147	D	94.2	Very high	93.9	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.011	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	121.1	-179.6	-178.8	-56.8	0	0	0	108.2	T90 S91 R135 R213	T90-D147 WeakPolarHBondContact CA-OD2 3.22Å; S91-D147 WeakPolarHBondContact CB-OD1 3.37Å; S91-D147 PolarHBondContact N-OD1 3.11Å; S91-D147 PolarHBondContact N-OD2 3.3Å; S91-D147 PolarHBondContact OG-OD1 3.35Å; R135-D147 PolarHBondContact N-O 3.33Å; R135-D147 PolarHBondContact O-N 3.25Å; D147-R213 HydrophobicContact CB-CG 4.39Å
148	G	92.8	Very high	94.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	156.7	-171.6	0	0	0	0	0	114.9	V133 F212	V133-G148 VanDerWaalsContact O-CA 3.31Å; V133-G148 WeakPolarHBondContact O-CA 3.16Å; G148-F212 PolarHBondContact N-O 2.89Å; G148-F212 PolarHBondContact O-N 3.23Å
149	T	93.5	Very high	94.3	Very high	17 Å²	17	35.2 Å²	35.2	10%	0.104	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.5	169	-56.9	0	0	0	0	109.3	T92 G132 V133 R209 A210	T92-T149 PolarHBondContact OG1-OG1 2.79Å; G132-T149 CarbonylContact C-O 3.5Å; G132-T149 WeakPolarHBondContact CA-O 3.47Å; V133-T149 PolarHBondContact N-O 2.87Å; V133-T149 PolarHBondContact O-N 2.98Å; T149-R209 HydrophobicContact CG2-CG 4.12Å; T149-A210 CarbonylContact C-O 3.57Å; T149-A210 VanDerWaalsContact CA-O 3.27Å; T149-A210 WeakPolarHBondContact CA-O 3.38Å
150	I	94.2	Very high	94.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.8	178.3	-50.3	175.9	0	0	0	108	L124 I130 V134 L153 L160 R209 A210 F212 V231	L124-I150 HydrophobicContact CD1-CD1 3.56Å; L124-I150 HydrophobicContact CD1-CG1 3.94Å; I130-I150 HydrophobicContact CG2-CG2 4.16Å; V134-I150 HydrophobicContact CG2-CG1 4.46Å; I150-L153 HydrophobicContact CB-CD1 4Å; I150-L153 HydrophobicContact CG2-CD1 3.74Å; I150-L153 HydrophobicContact CG2-CD2 4.24Å; I150-L153 HydrophobicContact CG2-CG 3.89Å; I150-L160 HydrophobicContact CD1-CD1 4.23Å; I150-R209 CarbonylContact O-C 3.56Å; I150-R209 WeakPolarHBondContact O-CA 3.18Å; I150-A210 PolarHBondContact N-O 2.89Å; I150-A210 PolarHBondContact O-N 2.82Å; I150-F212 HydrophobicContact CD1-CE1 3.88Å; I150-F212 HydrophobicContact CD1-CZ 4.13Å; I150-F212 HydrophobicContact CG1-CE1 3.99Å; I150-F212 HydrophobicContact CG1-CZ 4.39Å; I150-V231 HydrophobicContact CD1-CB 4.14Å; I150-V231 HydrophobicContact CD1-CG1 4.34Å; I150-V231 HydrophobicContact CD1-CG2 4.17Å
151	D	93.6	Very high	95.1	Very high	44 Å²	44	32.5 Å²	32.5	24%	0.235	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	151	-179.6	-76.2	-50.1	0	0	0	111.1	I130 Q131 G208 R209	I130-D151 WeakPolarHBondContact CA-O 3.4Å; Q131-D151 HydrophobicContact CG-CB 4.42Å; Q131-D151 PolarHBondContact N-O 2.95Å; Q131-D151 VanDerWaalsContact N-O 3.17Å; Q131-D151 PolarHBondContact O-N 2.65Å; D151-G208 CarbonylContact C-O 3.57Å; D151-R209 WeakPolarHBondContact OD1-CB 3.35Å; D151-R209 IonicContact OD1-CZ 3.66Å; D151-R209 VanDerWaalsContact OD1-CZ 3.29Å; D151-R209 IonicContact OD1-NE 3.13Å; D151-R209 PolarHBondContact OD1-NE 2.92Å; D151-R209 IonicContact OD1-NH2 3.15Å; D151-R209 PolarHBondContact OD1-NH2 2.67Å; D151-R209 IonicContact OD2-CZ 3.86Å; D151-R209 IonicContact OD2-NE 3.76Å; D151-R209 IonicContact OD2-NH2 2.88Å; D151-R209 PolarHBondContact OD2-NH2 3.39Å
152	G	93.1	Very high	95.6	Very high	35 Å²	35	25.8 Å²	25.8	36%	0.361	15%	0.151	S	C	.	.	S	Bend	trans	86.6	13.1	173	0	0	0	0	0	114.8	I130 G208	I130-G152 WeakPolarHBondContact CG1-O 3.48Å; G152-G208 PolarHBondContact N-O 2.78Å
153	L	94.8	Very high	96	Very high	9 Å²	9	20.8 Å²	20.8	5%	0.047	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-77.3	160.5	174.3	-64.6	174.2	0	0	0	111.2	I130 I150 A204 G208 A210 V231 L256	I130-L153 HydrophobicContact CD1-CD2 4.35Å; I130-L153 HydrophobicContact CG2-CD2 4.02Å; I150-L153 HydrophobicContact CB-CD1 4Å; I150-L153 HydrophobicContact CG2-CD1 3.74Å; I150-L153 HydrophobicContact CG2-CD2 4.24Å; I150-L153 HydrophobicContact CG2-CG 3.89Å; L153-A204 HydrophobicContact CB-CB 3.76Å; L153-A204 HydrophobicContact CD1-CB 4.16Å; L153-G208 PolarHBondContact N-O 3.06Å; L153-G208 WeakPolarHBondContact O-CA 3.44Å; L153-A210 HydrophobicContact CD1-CB 4Å; L153-V231 HydrophobicContact CD1-CG2 4.37Å; L153-V231 HydrophobicContact CD2-CG2 4.2Å; L153-L256 HydrophobicContact CD2-CD1 3.87Å
154	E	95.9	Very high	96.3	Very high	152 Å²	152	22 Å²	22	71%	0.71	14%	0.135	S	C	*	.	P	Polyproline II helix	trans	-71.9	148.2	166.4	-65.8	-166	158.1	0	0	109.8	G156 H158 A204	E154-G156 PolarHBondContact O-N 2.78Å; E154-H158 PolarHBondContact O-NE2 3.03Å; E154-A204 WeakPolarHBondContact O-CB 3.17Å
155	P	97.5	Very high	96.4	Very high	90 Å²	90	26.2 Å²	26.2	58%	0.584	16%	0.157	S	C	*	.	S	Bend	trans	-63.1	126.2	177.6	-23.9	34.8	0	0	0	111.8
156	G	97.9	Very high	96.5	Very high	21 Å²	21	27.4 Å²	27.4	22%	0.216	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.5	-174.6	-178.4	0	0	0	0	0	114.1	E154 H158 V203 A204	E154-G156 PolarHBondContact O-N 2.78Å; G156-H158 PolarHBondContact O-CD2 3.3Å; G156-V203 WeakPolarHBondContact O-CA 3.33Å; G156-A204 PolarHBondContact N-O 3.37Å; G156-A204 PolarHBondContact O-N 2.87Å
157	P	98.2	Very high	96.6	Very high	45 Å²	45	30.3 Å²	30.3	29%	0.292	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	139.2	175.9	31.4	-33.6	0	0	0	112.2	N201 V202 G234 E235	P157-N201 HydrophobicContact CB-CB 4.23Å; P157-V202 CarbonylContact C-O 3.54Å; P157-V202 WeakPolarHBondContact CA-O 3.36Å; P157-G234 CarbonylContact O-C 3.43Å; P157-E235 HydrophobicContact CB-CB 4.26Å; P157-E235 HydrophobicContact CB-CG 3.96Å; P157-E235 HydrophobicContact CG-CB 3.81Å; P157-E235 HydrophobicContact CG-CG 3.75Å; P157-E235 WeakPolarHBondContact CG-OE2 3.47Å; P157-E235 PolarHBondContact O-N 2.89Å
158	H	98.4	Very high	96.6	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.019	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	132.4	176.4	-71.3	-88.6	0	0	0	110.1	E154 G156 N201 V202 V231 D232 S233 G234	E154-H158 PolarHBondContact O-NE2 3.03Å; G156-H158 PolarHBondContact O-CD2 3.3Å; H158-N201 CarbonylContact O-C 3.54Å; H158-N201 VanDerWaalsContact O-CA 3.3Å; H158-N201 WeakPolarHBondContact O-CA 3.25Å; H158-V202 HydrophobicContact CB-CG2 4.2Å; H158-V202 PolarHBondContact N-O 3.42Å; H158-V202 PolarHBondContact O-N 3.35Å; H158-V231 HydrophobicContact CB-CG2 3.9Å; H158-D232 PolarHBondContact ND1-O 2.75Å; H158-S233 PolarHBondContact CE1-O 3.5Å; H158-S233 PolarHBondContact ND1-O 3.46Å; H158-G234 WeakPolarHBondContact CA-O 3.47Å
159	G	98.4	Very high	96.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	139.6	172.2	0	0	0	0	0	111.9	N201 V231 D232 G234	G159-N201 PolarHBondContact N-OD1 3.4Å; G159-V231 WeakPolarHBondContact O-CA 3.09Å; G159-D232 PolarHBondContact O-N 3.46Å; G159-G234 PolarHBondContact N-O 3.31Å
160	L	98.7	Very high	96.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.3	175.6	-171.2	77.9	0	0	0	110	I150 L199 G200 V202 F212 F214 L229 V230 V231	I150-L160 HydrophobicContact CD1-CD1 4.23Å; L160-L199 HydrophobicContact CD2-CB 4.46Å; L160-L199 HydrophobicContact CD2-CD1 3.88Å; L160-L199 HydrophobicContact CG-CD1 4.17Å; L160-L199 VanDerWaalsContact O-CB 3.27Å; L160-L199 WeakPolarHBondContact O-CB 3.18Å; L160-L199 PolarHBondContact O-N 3.46Å; L160-G200 PolarHBondContact N-O 3.16Å; L160-V202 HydrophobicContact CB-CG1 4.2Å; L160-V202 HydrophobicContact CD2-CG1 3.94Å; L160-F212 HydrophobicContact CD2-CE2 3.96Å; L160-F212 HydrophobicContact CD2-CZ 3.92Å; L160-F214 HydrophobicContact CD2-CZ 4.26Å; L160-L229 HydrophobicContact CD1-CD1 4.04Å; L160-L229 HydrophobicContact CD1-CD2 4.27Å; L160-L229 HydrophobicContact CD1-CG 4.09Å; L160-L229 HydrophobicContact CD2-CD1 4.32Å; L160-L229 HydrophobicContact CG-CD1 3.95Å; L160-V230 WeakPolarHBondContact CA-O 3.25Å; L160-V230 WeakPolarHBondContact CD1-O 3.45Å; L160-V231 HydrophobicContact CD1-CB 4.04Å
161	H	98.6	Very high	96.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.5	-173.9	-44.7	89.6	0	0	0	112.9	H178 H186 G197 D198 V230 D232 D236	H161-H178 AromaticContact CD2-CE1 3.21Å; H161-H178 PolarHBondContact CD2-CE1 2.82Å; H161-H178 AromaticContact CD2-ND1 3.56Å; H161-H178 AromaticContact CD2-NE2 3.94Å; H161-H178 AromaticContact CE1-CE1 3.91Å; H161-H178 AromaticContact CG-CE1 3.48Å; H161-H178 VanDerWaalsContact CG-CE1 3.48Å; H161-H178 AromaticContact CG-ND1 3.95Å; H161-H178 AromaticContact CG-NE2 3.75Å; H161-H178 AromaticContact ND1-CE1 3.95Å; H161-H178 AromaticContact NE2-CE1 3.51Å; H161-H186 AromaticContact NE2-CE1 3.84Å; H161-G197 CarbonylContact C-O 3.55Å; H161-G197 VanDerWaalsContact CA-O 3.26Å; H161-G197 WeakPolarHBondContact CA-O 3.32Å; H161-D198 IonicContact CD2-OD1 3.29Å; H161-V230 PolarHBondContact N-O 2.86Å; H161-V230 PolarHBondContact O-N 3.41Å; H161-D232 IonicContact CE1-OD2 3.51Å; H161-D232 PolarHBondContact CE1-OD2 2.86Å; H161-D232 VanDerWaalsContact CE1-OD2 3.32Å; H161-D232 IonicContact ND1-OD2 3.07Å; H161-D232 PolarHBondContact ND1-OD2 2.76Å; H161-D236 IonicContact CD2-OD2 3.06Å; H161-D236 IonicContact CE1-OD2 2.86Å; H161-D236 IonicContact NE2-OD2 3.73Å; H161-D236 PolarHBondContact NE2-OD2 3.18Å
162	V	98.8	Very high	96.8	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.6	164.4	179.5	0	0	0	0	108.4	F179 G197 L199 L219 V224 R227 S228 L229 I261	V162-F179 HydrophobicContact CB-CB 4.4Å; V162-F179 HydrophobicContact CG1-CB 4.08Å; V162-F179 VanDerWaalsContact O-CB 3.31Å; V162-F179 WeakPolarHBondContact O-CB 3.25Å; V162-F179 PolarHBondContact O-N 3.33Å; V162-G197 PolarHBondContact N-O 3.17Å; V162-L199 HydrophobicContact CG2-CD1 4.28Å; V162-L219 HydrophobicContact CG2-CD1 4.03Å; V162-V224 HydrophobicContact CG1-CB 4.3Å; V162-V224 HydrophobicContact CG1-CG1 4.1Å; V162-R227 HydrophobicContact CG1-CB 4.08Å; V162-S228 CarbonylContact C-O 3.53Å; V162-S228 WeakPolarHBondContact CA-O 3.26Å; V162-L229 HydrophobicContact CG2-CD1 4.01Å; V162-I261 HydrophobicContact CG1-CD1 3.83Å; V162-I261 HydrophobicContact CG2-CD1 3.96Å
163	H	98.7	Very high	96.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	163.8	177.2	-75.7	-119.3	0	0	0	111.8	L165 C175 G176 E177 H178 R227 S228 V230 R255	H163-L165 PolarHBondContact O-N 2.68Å; H163-C175 HydrophobicContact CB-CB 3.91Å; H163-C175 WeakPolarHBondContact CB-O 3.27Å; H163-G176 PolarHBondContact ND1-O 2.9Å; H163-E177 CarbonylContact C-O 3.56Å; H163-E177 VanDerWaalsContact CA-O 3.26Å; H163-E177 WeakPolarHBondContact CA-O 3.34Å; H163-H178 AromaticContact CE1-CD2 3.73Å; H163-H178 AromaticContact NE2-CD2 3.73Å; H163-R227 WeakPolarHBondContact O-CB 3.49Å; H163-S228 WeakPolarHBondContact CB-OG 3.31Å; H163-S228 PolarHBondContact N-O 2.92Å; H163-V230 HydrophobicContact CB-CG2 4.24Å; H163-V230 WeakPolarHBondContact CD2-CG2 3.37Å; H163-R255 VanDerWaalsContact CE1-CZ 3.41Å; H163-R255 PolarHBondContact CE1-NE 3.45Å; H163-R255 PolarHBondContact CE1-NH2 2.84Å
164	T	98.1	Very high	97	Very high	41 Å²	41	54.1 Å²	54.1	25%	0.252	31%	0.305	S	S	.	.	S	Bend	trans	-67.5	-34.1	-171.5	45.1	0	0	0	0	114.4	C175 E177 F179 R227	T164-C175 PolarHBondContact N-O 2.98Å; T164-E177 WeakPolarHBondContact CG2-O 3.49Å; T164-E177 PolarHBondContact N-O 3.16Å; T164-E177 PolarHBondContact OG1-N 3.13Å; T164-E177 PolarHBondContact OG1-O 3.22Å; T164-F179 HydrophobicContact CG2-CD2 4.47Å; T164-R227 PolarHBondContact O-NH1 3.32Å
165	L	98.2	Very high	97	Very high	89 Å²	89	46.9 Å²	46.9	47%	0.466	27%	0.271	S	S	.	.			trans	-119.1	133.9	-170.7	-52.8	176.7	0	0	0	111.9	H163 D167 C175 S228	H163-L165 PolarHBondContact O-N 2.68Å; L165-D167 HydrophobicContact CB-CB 4.29Å; L165-D167 PolarHBondContact O-N 2.67Å; L165-D167 VanDerWaalsContact O-N 3.13Å; L165-C175 WeakPolarHBondContact CB-O 3.07Å; L165-C175 PolarHBondContact N-O 2.91Å; L165-C175 WeakPolarHBondContact O-CA 3.41Å; L165-S228 WeakPolarHBondContact O-CB 3.28Å; L165-S228 PolarHBondContact O-OG 3.49Å
166	G	97.4	Very high	97	Very high	26 Å²	26	43.5 Å²	43.5	27%	0.268	25%	0.252	S	S	.	.			trans	-82.5	44.1	166.3	0	0	0	0	0	112.9	G226 I260	G166-G226 VanDerWaalsContact CA-O 3.27Å; G166-G226 WeakPolarHBondContact CA-O 3.43Å; G166-G226 PolarHBondContact N-O 3.49Å; G166-I260 VanDerWaalsContact O-CD1 3.27Å; G166-I260 WeakPolarHBondContact O-CD1 3.1Å
167	D	97.2	Very high	97	Very high	62 Å²	62	48.2 Å²	48.2	33%	0.332	27%	0.269	S	S	.	.			trans	-103.5	114	179.8	-174	-10.4	0	0	0	110	L165 T169 S174 C175	L165-D167 HydrophobicContact CB-CB 4.29Å; L165-D167 PolarHBondContact O-N 2.67Å; L165-D167 VanDerWaalsContact O-N 3.13Å; D167-T169 VanDerWaalsContact OD1-CB 3.25Å; D167-T169 WeakPolarHBondContact OD1-CB 3.27Å; D167-T169 WeakPolarHBondContact OD1-CG2 3.44Å; D167-T169 PolarHBondContact OD1-N 3.44Å; D167-T169 PolarHBondContact OD1-OG1 3.47Å; D167-T169 PolarHBondContact OD2-OG1 3.05Å; D167-S174 CarbonylContact O-C 3.46Å; D167-S174 WeakPolarHBondContact O-CB 3.31Å; D167-S174 PolarHBondContact O-OG 3.23Å; D167-C175 PolarHBondContact O-N 2.88Å
168	L	95.3	Very high	97	Very high	73 Å²	73	46.5 Å²	46.5	38%	0.382	26%	0.257	S	S	.	.			trans	-108.2	18.3	179.5	-55.2	-178.6	0	0	0	112.4	Q170 D171 C258 I260	L168-Q170 VanDerWaalsContact C-N 3.26Å; L168-Q170 PolarHBondContact O-N 3.14Å; L168-D171 PolarHBondContact O-N 2.86Å; L168-C258 HydrophobicContact CD2-CB 4.23Å; L168-I260 HydrophobicContact CD1-CD1 4.13Å; L168-I260 HydrophobicContact CD1-CG1 3.9Å; L168-I260 HydrophobicContact CG-CD1 4.26Å; L168-I260 HydrophobicContact CG-CG1 4.03Å
169	T	95.5	Very high	97	Very high	114 Å²	114	46.9 Å²	46.9	70%	0.699	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.5	-178.5	55.3	0	0	0	0	113.6	D167 S174	D167-T169 VanDerWaalsContact OD1-CB 3.25Å; D167-T169 WeakPolarHBondContact OD1-CB 3.27Å; D167-T169 WeakPolarHBondContact OD1-CG2 3.44Å; D167-T169 PolarHBondContact OD1-N 3.44Å; D167-T169 PolarHBondContact OD1-OG1 3.47Å; D167-T169 PolarHBondContact OD2-OG1 3.05Å; T169-S174 PolarHBondContact N-OG 2.86Å
170	Q	93.5	Very high	97	Very high	132 Å²	132	49 Å²	49	62%	0.617	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	47.9	174.1	-58.5	-170.6	-53.1	0	0	110.3	L168 C172 L173 S174	L168-Q170 VanDerWaalsContact C-N 3.26Å; L168-Q170 PolarHBondContact O-N 3.14Å; Q170-C172 PolarHBondContact O-N 2.8Å; Q170-L173 HydrophobicContact CB-CB 4.41Å; Q170-L173 WeakPolarHBondContact O-CB 3.44Å; Q170-L173 PolarHBondContact O-N 2.81Å; Q170-L173 VanDerWaalsContact O-N 3.1Å; Q170-S174 PolarHBondContact N-OG 3Å
171	D	92.4	Very high	97	Very high	129 Å²	129	52.4 Å²	52.4	69%	0.69	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	50.9	-131.9	-172	-57	-48.5	0	0	0	110.2	L168 L173 S174	L168-D171 PolarHBondContact O-N 2.86Å; D171-L173 VanDerWaalsContact C-N 3.29Å; D171-L173 PolarHBondContact O-N 3.06Å; D171-S174 PolarHBondContact O-OG 3.46Å
172	C	95.9	Very high	96.9	Very high	8 Å²	8	59.2 Å²	59.2	5%	0.054	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-82.2	-5.9	-177.7	-48.4	0	0	0	0	113.8	Q170 R255 C258	Q170-C172 PolarHBondContact O-N 2.8Å; C172-R255 HydrophobicContact CB-CB 3.63Å; C172-R255 WeakPolarHBondContact O-CD 3.3Å; C172-R255 PolarHBondContact O-NH1 2.96Å; C172-C258 WeakPolarHBondContact CA-SG 3.24Å; C172-C258 HydrophobicContact CB-CB 3.75Å; C172-C258 WeakPolarHBondContact CB-SG 3.42Å; C172-C258 PolarHBondContact N-SG 3.14Å; C172-C258 VanDerWaalsContact N-SG 3.37Å; C172-C258 WeakPolarHBondContact SG-CB 3.22Å; C172-C258 PolarHBondContact SG-N 3.29Å; C172-C258 CovalentContact SG-SG 2.05Å; C172-C258 PolarHBondContact SG-SG 3.01Å
173	L	95	Very high	96.8	Very high	136 Å²	136	62.3 Å²	62.3	71%	0.712	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-73.6	-32.3	-179.9	-59.9	176	0	0	0	111.6	Q170 D171 C175	Q170-L173 HydrophobicContact CB-CB 4.41Å; Q170-L173 WeakPolarHBondContact O-CB 3.44Å; Q170-L173 PolarHBondContact O-N 2.81Å; Q170-L173 VanDerWaalsContact O-N 3.1Å; D171-L173 VanDerWaalsContact C-N 3.29Å; D171-L173 PolarHBondContact O-N 3.06Å; L173-C175 VanDerWaalsContact C-N 3.29Å; L173-C175 PolarHBondContact O-N 3.35Å
174	S	96.6	Very high	96.7	Very high	15 Å²	15	64.8 Å²	64.8	11%	0.105	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-79.8	-4.2	179.1	46.1	0	0	0	0	114.3	D167 T169 Q170 D171 G176	D167-S174 CarbonylContact O-C 3.46Å; D167-S174 WeakPolarHBondContact O-CB 3.31Å; D167-S174 PolarHBondContact O-OG 3.23Å; T169-S174 PolarHBondContact N-OG 2.86Å; Q170-S174 PolarHBondContact N-OG 3Å; D171-S174 PolarHBondContact O-OG 3.46Å; S174-G176 PolarHBondContact O-N 3.13Å; S174-G176 VanDerWaalsContact O-N 3.14Å
175	C	97.4	Very high	96.7	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-68.4	-10.4	-179.1	-65.2	0	0	0	0	114.8	H163 T164 L165 D167 L173 S228 V230	H163-C175 HydrophobicContact CB-CB 3.91Å; H163-C175 WeakPolarHBondContact CB-O 3.27Å; T164-C175 PolarHBondContact N-O 2.98Å; L165-C175 WeakPolarHBondContact CB-O 3.07Å; L165-C175 PolarHBondContact N-O 2.91Å; L165-C175 WeakPolarHBondContact O-CA 3.41Å; D167-C175 PolarHBondContact O-N 2.88Å; L173-C175 VanDerWaalsContact C-N 3.29Å; L173-C175 PolarHBondContact O-N 3.35Å; C175-S228 VanDerWaalsContact CB-OG 3.28Å; C175-S228 WeakPolarHBondContact CB-OG 3.31Å; C175-S228 PolarHBondContact SG-OG 3.13Å; C175-S228 VanDerWaalsContact SG-OG 3.35Å; C175-V230 HydrophobicContact CB-CG2 4.32Å
176	G	97.3	Very high	96.7	Very high	19 Å²	19	63.6 Å²	63.6	20%	0.196	35%	0.354	C	S	.	.			trans	75.6	-158.6	-176.6	0	0	0	0	0	113.3	H163 S174 R255	H163-G176 PolarHBondContact ND1-O 2.9Å; S174-G176 PolarHBondContact O-N 3.13Å; S174-G176 VanDerWaalsContact O-N 3.14Å; G176-R255 PolarHBondContact O-NH1 2.97Å; G176-R255 PolarHBondContact O-NH2 2.8Å
177	E	97.8	Very high	96.7	Very high	119 Å²	119	62.5 Å²	62.5	56%	0.556	34%	0.342	S	S	*	.	S	Bend	trans	-85.2	173.3	-180	-59.1	-54.2	133.6	0	0	112.4	H163 T164	H163-E177 CarbonylContact C-O 3.56Å; H163-E177 VanDerWaalsContact CA-O 3.26Å; H163-E177 WeakPolarHBondContact CA-O 3.34Å; T164-E177 WeakPolarHBondContact CG2-O 3.49Å; T164-E177 PolarHBondContact N-O 3.16Å; T164-E177 PolarHBondContact OG1-N 3.13Å; T164-E177 PolarHBondContact OG1-O 3.22Å
178	H	98.5	Very high	96.6	Very high	9 Å²	9	59.7 Å²	59.7	4%	0.042	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-55.1	142.1	171.6	-66.8	-163	0	0	0	110.4	H161 H163 N180 H186 H195 D198	H161-H178 AromaticContact CD2-CE1 3.21Å; H161-H178 PolarHBondContact CD2-CE1 2.82Å; H161-H178 AromaticContact CD2-ND1 3.56Å; H161-H178 AromaticContact CD2-NE2 3.94Å; H161-H178 AromaticContact CE1-CE1 3.91Å; H161-H178 AromaticContact CG-CE1 3.48Å; H161-H178 VanDerWaalsContact CG-CE1 3.48Å; H161-H178 AromaticContact CG-ND1 3.95Å; H161-H178 AromaticContact CG-NE2 3.75Å; H161-H178 AromaticContact ND1-CE1 3.95Å; H161-H178 AromaticContact NE2-CE1 3.51Å; H163-H178 AromaticContact CE1-CD2 3.73Å; H163-H178 AromaticContact NE2-CD2 3.73Å; H178-N180 PolarHBondContact O-N 2.93Å; H178-H186 AromaticContact CE1-CE1 3.74Å; H178-H186 AromaticContact CE1-ND1 3.67Å; H178-H186 AromaticContact ND1-CE1 3.86Å; H178-H186 AromaticContact ND1-ND1 3.46Å; H178-H186 PolarHBondContact ND1-ND1 2.76Å; H178-H195 HydrophobicContact CB-CB 4.28Å; H178-H195 WeakPolarHBondContact CB-ND1 3.37Å; H178-H195 AromaticContact CG-ND1 3.87Å; H178-H195 AromaticContact ND1-ND1 3.61Å; H178-D198 IonicContact CE1-OD1 3.01Å; H178-D198 IonicContact CG-OD1 2.78Å; H178-D198 IonicContact ND1-OD1 3.76Å; H178-D198 PolarHBondContact ND1-OD1 3.47Å
179	F	98.6	Very high	96.6	Very high	13 Å²	13	58.4 Å²	58.4	6%	0.057	32%	0.324	C	S	.	.			trans	-68.5	103.6	-178.3	176.2	-126.5	0	0	0	111	V162 T164 P181 V196 G197 V224 R227	V162-F179 HydrophobicContact CB-CB 4.4Å; V162-F179 HydrophobicContact CG1-CB 4.08Å; V162-F179 VanDerWaalsContact O-CB 3.31Å; V162-F179 WeakPolarHBondContact O-CB 3.25Å; V162-F179 PolarHBondContact O-N 3.33Å; T164-F179 HydrophobicContact CG2-CD2 4.47Å; F179-P181 HydrophobicContact CE1-CG 4.09Å; F179-P181 HydrophobicContact CE2-CB 4.04Å; F179-P181 HydrophobicContact CE2-CG 3.93Å; F179-P181 HydrophobicContact CZ-CB 4.07Å; F179-P181 HydrophobicContact CZ-CG 3.62Å; F179-V196 HydrophobicContact CD1-CB 3.88Å; F179-V196 HydrophobicContact CD1-CG1 3.77Å; F179-V196 HydrophobicContact CE1-CB 4Å; F179-V196 HydrophobicContact CE1-CG1 3.65Å; F179-V196 PolarHBondContact O-N 2.81Å; F179-V196 VanDerWaalsContact O-N 3.07Å; F179-G197 PolarHBondContact O-N 2.73Å; F179-V224 HydrophobicContact CD1-CG1 4.21Å; F179-V224 HydrophobicContact CE1-CG1 4.2Å; F179-R227 VanDerWaalsContact CD2-CZ 3.48Å
180	N	97.9	Very high	96.4	Very high	44 Å²	44	56.8 Å²	56.8	24%	0.235	33%	0.33	C	S	.	.			trans	-131.6	73.9	-173.6	-174.2	13.3	0	0	0	112	H178 F182 G183 K184 H195	H178-N180 PolarHBondContact O-N 2.93Å; N180-F182 PolarHBondContact O-N 3.23Å; N180-G183 WeakPolarHBondContact ND2-CA 3.35Å; N180-G183 PolarHBondContact O-N 2.94Å; N180-G183 PolarHBondContact OD1-N 2.86Å; N180-K184 PolarHBondContact ND2-N 2.92Å; N180-K184 PolarHBondContact ND2-O 3.42Å; N180-K184 PolarHBondContact OD1-N 2.95Å; N180-H195 HydrophobicContact CB-CB 4Å; N180-H195 PolarHBondContact ND2-CD2 2.81Å; N180-H195 PolarHBondContact ND2-NE2 2.8Å
181	P	97.5	Very high	96.5	Very high	72 Å²	72	52.8 Å²	52.8	47%	0.468	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.9	-179.5	28.6	-35	0	0	0	113.3	F179 V196	F179-P181 HydrophobicContact CE1-CG 4.09Å; F179-P181 HydrophobicContact CE2-CB 4.04Å; F179-P181 HydrophobicContact CE2-CG 3.93Å; F179-P181 HydrophobicContact CZ-CB 4.07Å; F179-P181 HydrophobicContact CZ-CG 3.62Å; P181-V196 HydrophobicContact CG-CB 4.28Å; P181-V196 HydrophobicContact CG-CG2 3.69Å
182	F	97.1	Very high	96.5	Very high	142 Å²	142	51.3 Å²	51.3	62%	0.623	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	1.3	-174.6	-55.9	-59	0	0	0	114.1	N180 K184 V196	N180-F182 PolarHBondContact O-N 3.23Å; F182-K184 VanDerWaalsContact C-N 3.28Å; F182-K184 HydrophobicContact CB-CD 4.4Å; F182-K184 HydrophobicContact CB-CG 4.15Å; F182-K184 PolarHBondContact O-N 2.84Å; F182-V196 HydrophobicContact CD2-CG2 3.61Å; F182-V196 HydrophobicContact CE2-CG2 3.58Å
183	G	96.4	Very high	96.5	Very high	65 Å²	65	55.5 Å²	55.5	67%	0.67	33%	0.331	S	S	*	.			trans	63.4	29.9	179	0	0	0	0	0	114.4	N180	N180-G183 WeakPolarHBondContact ND2-CA 3.35Å; N180-G183 PolarHBondContact O-N 2.94Å; N180-G183 PolarHBondContact OD1-N 2.86Å
184	K	97.2	Very high	96.6	Very high	53 Å²	53	49.2 Å²	49.2	23%	0.23	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-76.7	167.3	178	-70	-179	173	-178.3	0	111.8	N180 F182 S192 E193 R194 H195	N180-K184 PolarHBondContact ND2-N 2.92Å; N180-K184 PolarHBondContact ND2-O 3.42Å; N180-K184 PolarHBondContact OD1-N 2.95Å; F182-K184 VanDerWaalsContact C-N 3.28Å; F182-K184 HydrophobicContact CB-CD 4.4Å; F182-K184 HydrophobicContact CB-CG 4.15Å; F182-K184 PolarHBondContact O-N 2.84Å; K184-S192 PolarHBondContact NZ-O 2.75Å; K184-E193 WeakPolarHBondContact CA-OE1 3.22Å; K184-E193 WeakPolarHBondContact CB-OE1 3.34Å; K184-R194 WeakPolarHBondContact CB-O 3.38Å; K184-R194 WeakPolarHBondContact CD-O 3.15Å; K184-H195 PolarHBondContact O-CD2 3.11Å; K184-H195 PolarHBondContact O-NE2 3.09Å; K184-H195 VanDerWaalsContact O-NE2 3.13Å
185	Q	97.4	Very high	96.7	Very high	103 Å²	103	49.1 Å²	49.1	48%	0.481	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-80.2	159.8	167.4	-64.8	-174.7	5.9	0	0	111.4	E193 R194 H195	Q185-E193 PolarHBondContact N-OE1 2.64Å; Q185-R194 CarbonylContact O-C 3.34Å; Q185-R194 WeakPolarHBondContact O-CA 3.37Å; Q185-H195 PolarHBondContact O-N 2.95Å
186	H	98.1	Very high	96.8	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.009	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-60.4	141.6	171.8	-174.7	81.4	0	0	0	111.8	H161 H178 H195 D198 D236 G239 S246 K247 G250	H161-H186 AromaticContact NE2-CE1 3.84Å; H178-H186 AromaticContact CE1-CE1 3.74Å; H178-H186 AromaticContact CE1-ND1 3.67Å; H178-H186 AromaticContact ND1-CE1 3.86Å; H178-H186 AromaticContact ND1-ND1 3.46Å; H178-H186 PolarHBondContact ND1-ND1 2.76Å; H186-H195 PolarHBondContact N-NE2 3.12Å; H186-H195 AromaticContact ND1-ND1 3.8Å; H186-D198 WeakPolarHBondContact CA-OD2 3.14Å; H186-D198 IonicContact CE1-OD1 2.83Å; H186-D198 IonicContact CE1-OD2 3.81Å; H186-D198 IonicContact CG-OD2 3.01Å; H186-D198 IonicContact ND1-OD1 2.77Å; H186-D198 PolarHBondContact ND1-OD1 2.83Å; H186-D198 IonicContact ND1-OD2 3.65Å; H186-D198 PolarHBondContact ND1-OD2 3.42Å; H186-D236 IonicContact CD2-OD1 2.72Å; H186-D236 IonicContact CE1-OD1 3.18Å; H186-D236 IonicContact CE1-OD2 2.67Å; H186-D236 PolarHBondContact CE1-OD2 3.08Å; H186-D236 VanDerWaalsContact NE2-CG 3.27Å; H186-D236 IonicContact NE2-OD1 3.42Å; H186-D236 PolarHBondContact NE2-OD1 2.85Å; H186-D236 IonicContact NE2-OD2 3.77Å; H186-D236 PolarHBondContact NE2-OD2 3.21Å; H186-G239 PolarHBondContact CD2-N 3.24Å; H186-S246 PolarHBondContact CD2-O 3.42Å; H186-S246 VanDerWaalsContact CD2-O 3.23Å; H186-K247 VanDerWaalsContact CB-O 3.27Å; H186-K247 WeakPolarHBondContact CB-O 3.4Å; H186-K247 PolarHBondContact N-O 3.35Å; H186-G250 VanDerWaalsContact CD2-CA 3.45Å; H186-G250 WeakPolarHBondContact CD2-CA 3.38Å; H186-G250 PolarHBondContact CD2-N 2.88Å; H186-G250 VanDerWaalsContact CD2-N 3.33Å; H186-G250 VanDerWaalsContact NE2-CA 3.3Å; H186-G250 WeakPolarHBondContact NE2-CA 3.45Å; H186-G250 PolarHBondContact NE2-N 3.17Å
187	G	97.4	Very high	96.8	Very high	3 Å²	3	48.5 Å²	48.5	3%	0.031	29%	0.288	C	S	.	.			trans	-157.8	176.5	178.7	0	0	0	0	0	113.2	D198	G187-D198 PolarHBondContact N-OD2 3.1Å; G187-D198 VanDerWaalsContact N-OD2 3.12Å; G187-D198 WeakPolarHBondContact O-CB 3.49Å
188	G	96.5	Very high	96.8	Very high	2 Å²	2	42.8 Å²	42.8	2%	0.021	26%	0.262	C	S	.	.			trans	-85	163.3	173.9	0	0	0	0	0	112.2	G190 D191 R194	G188-G190 PolarHBondContact O-N 2.87Å; G188-D191 WeakPolarHBondContact CA-OD2 3.45Å; G188-D191 PolarHBondContact N-OD2 3.37Å; G188-D191 WeakPolarHBondContact O-CB 3.45Å; G188-D191 PolarHBondContact O-N 2.86Å; G188-R194 VanDerWaalsContact O-CD 3.3Å; G188-R194 WeakPolarHBondContact O-CD 3.35Å
189	P	94.8	Very high	96.8	Very high	47 Å²	47	42.4 Å²	42.4	31%	0.305	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.7	-172.8	20.8	-33.2	0	0	0	114.5	D191 R194	P189-D191 VanDerWaalsContact C-N 3.34Å; P189-R194 PolarHBondContact O-NE 2.82Å
190	G	92	Very high	96.8	Very high	80 Å²	80	41.8 Å²	41.8	83%	0.825	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.2	175.9	0	0	0	0	0	115.1	G188	G188-G190 PolarHBondContact O-N 2.87Å
191	D	94.9	Very high	96.8	Very high	48 Å²	48	41 Å²	41	26%	0.257	25%	0.253	S	S	.	.			trans	-84.8	139.5	-179.7	-60.7	-49.4	0	0	0	110.9	G188 P189 E193 R194 Q218 R240	G188-D191 WeakPolarHBondContact CA-OD2 3.45Å; G188-D191 PolarHBondContact N-OD2 3.37Å; G188-D191 WeakPolarHBondContact O-CB 3.45Å; G188-D191 PolarHBondContact O-N 2.86Å; P189-D191 VanDerWaalsContact C-N 3.34Å; D191-E193 VanDerWaalsContact C-N 3.3Å; D191-R194 WeakPolarHBondContact O-CG 3.39Å; D191-Q218 PolarHBondContact O-NE2 2.82Å; D191-R240 IonicContact OD1-NH2 2.83Å; D191-R240 PolarHBondContact OD1-NH2 3.12Å; D191-R240 IonicContact OD2-CZ 3.4Å; D191-R240 IonicContact OD2-NH1 2.79Å; D191-R240 PolarHBondContact OD2-NH1 3.18Å; D191-R240 IonicContact OD2-NH2 2.84Å; D191-R240 PolarHBondContact OD2-NH2 2.51Å
192	S	92.6	Very high	96.8	Very high	98 Å²	98	37.8 Å²	37.8	69%	0.685	23%	0.232	S	C	*	.	S	Bend	trans	-71.6	-31.6	169.4	54.6	0	0	0	0	111.5	K184	K184-S192 PolarHBondContact NZ-O 2.75Å
193	E	95.4	Very high	96.8	Very high	95 Å²	95	35.7 Å²	35.7	44%	0.444	23%	0.231	S	C	.	.	S	Bend	trans	-95.4	92.8	174.5	-167.5	65.3	-162.6	0	0	109.2	K184 Q185 D191	K184-E193 WeakPolarHBondContact CA-OE1 3.22Å; K184-E193 WeakPolarHBondContact CB-OE1 3.34Å; Q185-E193 PolarHBondContact N-OE1 2.64Å; D191-E193 VanDerWaalsContact C-N 3.3Å
194	R	98.1	Very high	96.8	Very high	5 Å²	5	32.9 Å²	32.9	2%	0.019	20%	0.201	C	C	.	.	S	Bend	trans	-155.2	164.3	175.6	64.3	173.6	173.4	105.1	-1.5	109.9	K184 Q185 G188 P189 D191 D198 D216	K184-R194 WeakPolarHBondContact CB-O 3.38Å; K184-R194 WeakPolarHBondContact CD-O 3.15Å; Q185-R194 CarbonylContact O-C 3.34Å; Q185-R194 WeakPolarHBondContact O-CA 3.37Å; G188-R194 VanDerWaalsContact O-CD 3.3Å; G188-R194 WeakPolarHBondContact O-CD 3.35Å; P189-R194 PolarHBondContact O-NE 2.82Å; D191-R194 WeakPolarHBondContact O-CG 3.39Å; R194-D198 HydrophobicContact CB-CB 4.31Å; R194-D198 PolarHBondContact NH1-O 2.91Å; R194-D216 IonicContact CZ-OD1 3.82Å; R194-D216 IonicContact CZ-OD2 3.38Å; R194-D216 IonicContact NH1-OD1 3.84Å; R194-D216 IonicContact NH1-OD2 3.31Å; R194-D216 PolarHBondContact NH1-OD2 3.32Å; R194-D216 IonicContact NH2-OD1 3.18Å; R194-D216 PolarHBondContact NH2-OD1 2.87Å; R194-D216 IonicContact NH2-OD2 3.6Å; R194-D216 PolarHBondContact NH2-OD2 3.21Å
195	H	98.4	Very high	96.6	Very high	13 Å²	13	31.4 Å²	31.4	6%	0.06	20%	0.201	C	C	.	.			trans	-67.4	151	163.6	-46.6	138.5	0	0	0	110.1	H178 N180 K184 Q185 H186 G197 D198 L248	H178-H195 HydrophobicContact CB-CB 4.28Å; H178-H195 WeakPolarHBondContact CB-ND1 3.37Å; H178-H195 AromaticContact CG-ND1 3.87Å; H178-H195 AromaticContact ND1-ND1 3.61Å; N180-H195 HydrophobicContact CB-CB 4Å; N180-H195 PolarHBondContact ND2-CD2 2.81Å; N180-H195 PolarHBondContact ND2-NE2 2.8Å; K184-H195 PolarHBondContact O-CD2 3.11Å; K184-H195 PolarHBondContact O-NE2 3.09Å; K184-H195 VanDerWaalsContact O-NE2 3.13Å; Q185-H195 PolarHBondContact O-N 2.95Å; H186-H195 PolarHBondContact N-NE2 3.12Å; H186-H195 AromaticContact ND1-ND1 3.8Å; H195-G197 PolarHBondContact O-N 3.21Å; H195-D198 HydrophobicContact CB-CB 4.49Å; H195-D198 VanDerWaalsContact CB-CG 3.49Å; H195-D198 WeakPolarHBondContact CB-OD1 3.48Å; H195-D198 WeakPolarHBondContact CB-OD2 3.26Å; H195-D198 IonicContact CG-OD1 2.79Å; H195-D198 IonicContact CG-OD2 3.55Å; H195-D198 PolarHBondContact N-OD2 3.37Å; H195-D198 IonicContact ND1-OD1 3.64Å; H195-D198 PolarHBondContact ND1-OD1 2.7Å; H195-D198 VanDerWaalsContact ND1-OD1 3.13Å; H195-D198 IonicContact ND1-OD2 3.09Å; H195-D198 PolarHBondContact ND1-OD2 2.98Å; H195-D198 PolarHBondContact O-N 2.79Å; H195-D198 VanDerWaalsContact O-N 3.1Å; H195-L248 PolarHBondContact CE1-O 3.43Å; H195-L248 VanDerWaalsContact CE1-O 3.29Å
196	V	98	Very high	96.5	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.03	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-32.1	176.5	175	0	0	0	0	110.8	F179 P181 F182 D198 L219	F179-V196 HydrophobicContact CD1-CB 3.88Å; F179-V196 HydrophobicContact CD1-CG1 3.77Å; F179-V196 HydrophobicContact CE1-CB 4Å; F179-V196 HydrophobicContact CE1-CG1 3.65Å; F179-V196 PolarHBondContact O-N 2.81Å; F179-V196 VanDerWaalsContact O-N 3.07Å; P181-V196 HydrophobicContact CG-CB 4.28Å; P181-V196 HydrophobicContact CG-CG2 3.69Å; F182-V196 HydrophobicContact CD2-CG2 3.61Å; F182-V196 HydrophobicContact CE2-CG2 3.58Å; V196-D198 VanDerWaalsContact C-N 3.33Å; V196-L219 HydrophobicContact CG1-CD1 4.1Å; V196-L219 VanDerWaalsContact O-CD1 3.31Å; V196-L219 WeakPolarHBondContact O-CD1 3.4Å
197	G	98	Very high	96.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.7	176.4	0	0	0	0	0	116	H161 V162 F179 H195 L199	H161-G197 CarbonylContact C-O 3.55Å; H161-G197 VanDerWaalsContact CA-O 3.26Å; H161-G197 WeakPolarHBondContact CA-O 3.32Å; V162-G197 PolarHBondContact N-O 3.17Å; F179-G197 PolarHBondContact O-N 2.73Å; H195-G197 PolarHBondContact O-N 3.21Å; G197-L199 PolarHBondContact O-N 2.95Å
198	D	98.5	Very high	96	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	107.1	-178.6	-62.8	-18.1	0	0	0	110.3	H161 H178 H186 G187 R194 H195 V196	H161-D198 IonicContact CD2-OD1 3.29Å; H178-D198 IonicContact CE1-OD1 3.01Å; H178-D198 IonicContact CG-OD1 2.78Å; H178-D198 IonicContact ND1-OD1 3.76Å; H178-D198 PolarHBondContact ND1-OD1 3.47Å; H186-D198 WeakPolarHBondContact CA-OD2 3.14Å; H186-D198 IonicContact CE1-OD1 2.83Å; H186-D198 IonicContact CE1-OD2 3.81Å; H186-D198 IonicContact CG-OD2 3.01Å; H186-D198 IonicContact ND1-OD1 2.77Å; H186-D198 PolarHBondContact ND1-OD1 2.83Å; H186-D198 IonicContact ND1-OD2 3.65Å; H186-D198 PolarHBondContact ND1-OD2 3.42Å; G187-D198 PolarHBondContact N-OD2 3.1Å; G187-D198 VanDerWaalsContact N-OD2 3.12Å; G187-D198 WeakPolarHBondContact O-CB 3.49Å; R194-D198 HydrophobicContact CB-CB 4.31Å; R194-D198 PolarHBondContact NH1-O 2.91Å; H195-D198 HydrophobicContact CB-CB 4.49Å; H195-D198 VanDerWaalsContact CB-CG 3.49Å; H195-D198 WeakPolarHBondContact CB-OD1 3.48Å; H195-D198 WeakPolarHBondContact CB-OD2 3.26Å; H195-D198 IonicContact CG-OD1 2.79Å; H195-D198 IonicContact CG-OD2 3.55Å; H195-D198 PolarHBondContact N-OD2 3.37Å; H195-D198 IonicContact ND1-OD1 3.64Å; H195-D198 PolarHBondContact ND1-OD1 2.7Å; H195-D198 VanDerWaalsContact ND1-OD1 3.13Å; H195-D198 IonicContact ND1-OD2 3.09Å; H195-D198 PolarHBondContact ND1-OD2 2.98Å; H195-D198 PolarHBondContact O-N 2.79Å; H195-D198 VanDerWaalsContact O-N 3.1Å; V196-D198 VanDerWaalsContact C-N 3.33Å
199	L	98.1	Very high	95.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-5	-179.5	-49	177.4	0	0	0	112.9	I146 L160 V162 G197 F214 L219 L229	I146-L199 HydrophobicContact CD1-CD1 4.21Å; I146-L199 HydrophobicContact CD1-CD2 3.87Å; L160-L199 HydrophobicContact CD2-CB 4.46Å; L160-L199 HydrophobicContact CD2-CD1 3.88Å; L160-L199 HydrophobicContact CG-CD1 4.17Å; L160-L199 VanDerWaalsContact O-CB 3.27Å; L160-L199 WeakPolarHBondContact O-CB 3.18Å; L160-L199 PolarHBondContact O-N 3.46Å; V162-L199 HydrophobicContact CG2-CD1 4.28Å; G197-L199 PolarHBondContact O-N 2.95Å; L199-F214 HydrophobicContact CB-CE2 4.02Å; L199-F214 HydrophobicContact CB-CZ 3.93Å; L199-F214 HydrophobicContact CD1-CZ 4.45Å; L199-F214 HydrophobicContact CD2-CE2 4.49Å; L199-L219 HydrophobicContact CD2-CD1 4.46Å; L199-L219 HydrophobicContact CD2-CD2 4.19Å; L199-L229 HydrophobicContact CD1-CD1 3.91Å
200	G	97.8	Very high	95.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	82.5	-142.9	-179.1	0	0	0	0	0	112.7	L160	L160-G200 PolarHBondContact N-O 3.16Å
201	N	98.3	Very high	95.8	Very high	28 Å²	28	39.9 Å²	39.9	15%	0.15	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.2	-174.9	-69.8	-62.3	0	0	0	112	P157 H158 G159 D236	P157-N201 HydrophobicContact CB-CB 4.23Å; H158-N201 CarbonylContact O-C 3.54Å; H158-N201 VanDerWaalsContact O-CA 3.3Å; H158-N201 WeakPolarHBondContact O-CA 3.25Å; G159-N201 PolarHBondContact N-OD1 3.4Å; N201-D236 PolarHBondContact ND2-O 2.97Å; N201-D236 WeakPolarHBondContact OD1-CB 3.33Å; N201-D236 PolarHBondContact OD1-N 2.82Å
202	V	97.9	Very high	95.8	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.5	163	-61.9	0	0	0	0	109.3	P157 H158 L160 A210 F212 F214	P157-V202 CarbonylContact C-O 3.54Å; P157-V202 WeakPolarHBondContact CA-O 3.36Å; H158-V202 HydrophobicContact CB-CG2 4.2Å; H158-V202 PolarHBondContact N-O 3.42Å; H158-V202 PolarHBondContact O-N 3.35Å; L160-V202 HydrophobicContact CB-CG1 4.2Å; L160-V202 HydrophobicContact CD2-CG1 3.94Å; V202-A210 HydrophobicContact CB-CB 4.5Å; V202-A210 HydrophobicContact CG2-CB 4.36Å; V202-F212 HydrophobicContact CB-CD1 3.76Å; V202-F212 HydrophobicContact CB-CE1 4Å; V202-F212 HydrophobicContact CB-CG 4.3Å; V202-F212 HydrophobicContact CG1-CB 4.35Å; V202-F212 HydrophobicContact CG1-CD1 3.5Å; V202-F212 HydrophobicContact CG1-CD2 4Å; V202-F212 HydrophobicContact CG1-CE1 3.64Å; V202-F212 HydrophobicContact CG1-CE2 4.1Å; V202-F212 HydrophobicContact CG1-CG 3.68Å; V202-F212 HydrophobicContact CG1-CZ 3.93Å; V202-F212 HydrophobicContact CG2-CD1 4.46Å; V202-F212 HydrophobicContact CG2-CE1 4.25Å; V202-F214 HydrophobicContact CG1-CE1 4.36Å
203	V	97.6	Very high	95.9	Very high	98 Å²	98	34 Å²	34	59%	0.594	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.9	-174.1	-175.9	0	0	0	0	110.1	G156 A210	G156-V203 WeakPolarHBondContact O-CA 3.33Å; V203-A210 WeakPolarHBondContact O-CA 3.48Å; V203-A210 WeakPolarHBondContact O-CB 3.35Å
204	A	96.6	Very high	95.8	Very high	5 Å²	5	29.8 Å²	29.8	4%	0.041	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	131.5	171.8	0	0	0	0	0	110.8	L153 E154 G156 R209 A210	L153-A204 HydrophobicContact CB-CB 3.76Å; L153-A204 HydrophobicContact CD1-CB 4.16Å; E154-A204 WeakPolarHBondContact O-CB 3.17Å; G156-A204 PolarHBondContact N-O 3.37Å; G156-A204 PolarHBondContact O-N 2.87Å; A204-R209 WeakPolarHBondContact CA-O 3.18Å; A204-A210 HydrophobicContact CB-CB 4.21Å
205	G	92.8	Very high	95.7	Very high	23 Å²	23	32.2 Å²	32.2	24%	0.237	18%	0.184	C	C	.	.			trans	-73	179.9	175.7	0	0	0	0	0	113.5	D207 G208 R209	G205-D207 PolarHBondContact O-N 2.05Å; G205-D207 VanDerWaalsContact O-N 3.13Å; G205-G208 PolarHBondContact O-N 2.96Å; G205-R209 PolarHBondContact N-O 2.82Å
206	P	94	Very high	95.6	Very high	130 Å²	130	31.8 Å²	31.8	84%	0.844	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.8	178.4	-23.2	34.2	0	0	0	114.8	G208	P206-G208 VanDerWaalsContact C-N 3.29Å
207	D	92.5	Very high	95.4	Very high	121 Å²	121	39.7 Å²	39.7	65%	0.647	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	1.2	174.7	60.4	-14.6	0	0	0	113.1	G205 R209	G205-D207 PolarHBondContact O-N 2.05Å; G205-D207 VanDerWaalsContact O-N 3.13Å; D207-R209 VanDerWaalsContact C-N 3.27Å; D207-R209 PolarHBondContact O-N 3.28Å; D207-R209 PolarHBondContact OD1-N 3.39Å
208	G	92.4	Very high	95.3	Very high	6 Å²	6	42 Å²	42	6%	0.062	22%	0.222	C	C	.	.	S	Bend	trans	73.9	17.1	-177.9	0	0	0	0	0	113.7	D151 G152 L153 G205 P206	D151-G208 CarbonylContact C-O 3.57Å; G152-G208 PolarHBondContact N-O 2.78Å; L153-G208 PolarHBondContact N-O 3.06Å; L153-G208 WeakPolarHBondContact O-CA 3.44Å; G205-G208 PolarHBondContact O-N 2.96Å; P206-G208 VanDerWaalsContact C-N 3.29Å
209	R	93.1	Very high	95.3	Very high	103 Å²	103	42 Å²	42	39%	0.389	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.6	177.3	174.7	170.9	-76.7	-168.2	-8.9	110.8	T149 I150 D151 A204 G205 D207	T149-R209 HydrophobicContact CG2-CG 4.12Å; I150-R209 CarbonylContact O-C 3.56Å; I150-R209 WeakPolarHBondContact O-CA 3.18Å; D151-R209 WeakPolarHBondContact OD1-CB 3.35Å; D151-R209 IonicContact OD1-CZ 3.66Å; D151-R209 VanDerWaalsContact OD1-CZ 3.29Å; D151-R209 IonicContact OD1-NE 3.13Å; D151-R209 PolarHBondContact OD1-NE 2.92Å; D151-R209 IonicContact OD1-NH2 3.15Å; D151-R209 PolarHBondContact OD1-NH2 2.67Å; D151-R209 IonicContact OD2-CZ 3.86Å; D151-R209 IonicContact OD2-NE 3.76Å; D151-R209 IonicContact OD2-NH2 2.88Å; D151-R209 PolarHBondContact OD2-NH2 3.39Å; A204-R209 WeakPolarHBondContact CA-O 3.18Å; G205-R209 PolarHBondContact N-O 2.82Å; D207-R209 VanDerWaalsContact C-N 3.27Å; D207-R209 PolarHBondContact O-N 3.28Å; D207-R209 PolarHBondContact OD1-N 3.39Å
210	A	94.1	Very high	95.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.5	165.7	0	0	0	0	0	109.1	T149 I150 L153 V202 V203 A204 F212	T149-A210 CarbonylContact C-O 3.57Å; T149-A210 VanDerWaalsContact CA-O 3.27Å; T149-A210 WeakPolarHBondContact CA-O 3.38Å; I150-A210 PolarHBondContact N-O 2.89Å; I150-A210 PolarHBondContact O-N 2.82Å; L153-A210 HydrophobicContact CD1-CB 4Å; V202-A210 HydrophobicContact CB-CB 4.5Å; V202-A210 HydrophobicContact CG2-CB 4.36Å; V203-A210 WeakPolarHBondContact O-CA 3.48Å; V203-A210 WeakPolarHBondContact O-CB 3.35Å; A204-A210 HydrophobicContact CB-CB 4.21Å; A210-F212 HydrophobicContact CB-CD1 4.37Å
211	S	93	Very high	95.2	Very high	55 Å²	55	43.2 Å²	43.2	39%	0.385	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.6	171.9	-175.8	0	0	0	0	108.1
212	F	94.7	Very high	95.1	Very high	17 Å²	17	47.6 Å²	47.6	8%	0.075	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	150.9	-170.6	54.8	-93.7	0	0	0	111.7	V134 I146 G148 I150 L160 V202 A210 F214	V134-F212 HydrophobicContact CG1-CE2 4.16Å; V134-F212 HydrophobicContact CG1-CZ 4.36Å; V134-F212 HydrophobicContact CG2-CE2 4.46Å; V134-F212 HydrophobicContact CG2-CZ 3.84Å; I146-F212 HydrophobicContact CG2-CE2 4.21Å; G148-F212 PolarHBondContact N-O 2.89Å; G148-F212 PolarHBondContact O-N 3.23Å; I150-F212 HydrophobicContact CD1-CE1 3.88Å; I150-F212 HydrophobicContact CD1-CZ 4.13Å; I150-F212 HydrophobicContact CG1-CE1 3.99Å; I150-F212 HydrophobicContact CG1-CZ 4.39Å; L160-F212 HydrophobicContact CD2-CE2 3.96Å; L160-F212 HydrophobicContact CD2-CZ 3.92Å; V202-F212 HydrophobicContact CB-CD1 3.76Å; V202-F212 HydrophobicContact CB-CE1 4Å; V202-F212 HydrophobicContact CB-CG 4.3Å; V202-F212 HydrophobicContact CG1-CB 4.35Å; V202-F212 HydrophobicContact CG1-CD1 3.5Å; V202-F212 HydrophobicContact CG1-CD2 4Å; V202-F212 HydrophobicContact CG1-CE1 3.64Å; V202-F212 HydrophobicContact CG1-CE2 4.1Å; V202-F212 HydrophobicContact CG1-CG 3.68Å; V202-F212 HydrophobicContact CG1-CZ 3.93Å; V202-F212 HydrophobicContact CG2-CD1 4.46Å; V202-F212 HydrophobicContact CG2-CE1 4.25Å; A210-F212 HydrophobicContact CB-CD1 4.37Å; F212-F214 HydrophobicContact CB-CD1 4.46Å; F212-F214 AromaticContact CD2-CD1 3.92Å; F212-F214 HydrophobicContact CD2-CD1 3.92Å; F212-F214 AromaticContact CD2-CE1 3.45Å; F212-F214 HydrophobicContact CD2-CE1 3.45Å; F212-F214 VanDerWaalsContact CD2-CE1 3.45Å; F212-F214 HydrophobicContact CD2-CZ 4.49Å; F212-F214 AromaticContact CE2-CE1 3.95Å; F212-F214 HydrophobicContact CE2-CE1 3.95Å; F212-F214 HydrophobicContact CG-CE1 4.27Å
213	R	93.6	Very high	95	Very high	6 Å²	6	51.1 Å²	51.1	2%	0.023	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	119.6	172.9	176	179.4	171.9	163.2	0.3	110.4	T40 R42 A87 A88 L89 T90 L145 I146 D147	T40-R213 HydrophobicContact CG2-CG 3.88Å; R42-R213 PolarHBondContact O-NH2 2.9Å; A87-R213 PolarHBondContact O-NH1 2.65Å; A87-R213 PolarHBondContact O-NH2 3.39Å; A88-R213 WeakPolarHBondContact O-CD 3.13Å; A88-R213 PolarHBondContact O-NH1 3.05Å; L89-R213 PolarHBondContact O-NH1 3.47Å; T90-R213 HydrophobicContact CG2-CB 3.84Å; L145-R213 HydrophobicContact CD1-CG 3.84Å; I146-R213 CarbonylContact O-C 3.53Å; I146-R213 VanDerWaalsContact O-CA 3.26Å; I146-R213 WeakPolarHBondContact O-CA 3.34Å; D147-R213 HydrophobicContact CB-CG 4.39Å
214	F	94.8	Very high	95.1	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	167	-177.7	58.8	-95.1	0	0	0	112.2	M38 I146 L160 L199 V202 F212	M38-F214 HydrophobicContact CB-CB 4.07Å; M38-F214 HydrophobicContact CE-CB 4.14Å; M38-F214 HydrophobicContact CE-CD1 3.55Å; M38-F214 HydrophobicContact CE-CD2 3.91Å; M38-F214 HydrophobicContact CE-CE1 3.77Å; M38-F214 HydrophobicContact CE-CE2 4.12Å; M38-F214 HydrophobicContact CE-CG 3.62Å; M38-F214 HydrophobicContact CE-CZ 4.06Å; M38-F214 VanDerWaalsContact O-CA 3.25Å; M38-F214 WeakPolarHBondContact O-CA 3.37Å; M38-F214 WeakPolarHBondContact O-CB 3.36Å; I146-F214 HydrophobicContact CB-CD2 4.3Å; I146-F214 HydrophobicContact CB-CE2 4.06Å; I146-F214 HydrophobicContact CB-CZ 4.23Å; I146-F214 HydrophobicContact CD1-CD2 3.98Å; I146-F214 HydrophobicContact CD1-CE2 3.41Å; I146-F214 VanDerWaalsContact CD1-CE2 3.41Å; I146-F214 HydrophobicContact CD1-CZ 4.11Å; I146-F214 HydrophobicContact CG1-CE2 4.34Å; I146-F214 HydrophobicContact CG2-CE1 4.34Å; I146-F214 HydrophobicContact CG2-CE2 4.31Å; I146-F214 HydrophobicContact CG2-CZ 3.99Å; I146-F214 PolarHBondContact N-O 2.94Å; I146-F214 PolarHBondContact O-N 3.25Å; L160-F214 HydrophobicContact CD2-CZ 4.26Å; L199-F214 HydrophobicContact CB-CE2 4.02Å; L199-F214 HydrophobicContact CB-CZ 3.93Å; L199-F214 HydrophobicContact CD1-CZ 4.45Å; L199-F214 HydrophobicContact CD2-CE2 4.49Å; V202-F214 HydrophobicContact CG1-CE1 4.36Å; F212-F214 HydrophobicContact CB-CD1 4.46Å; F212-F214 AromaticContact CD2-CD1 3.92Å; F212-F214 HydrophobicContact CD2-CD1 3.92Å; F212-F214 AromaticContact CD2-CE1 3.45Å; F212-F214 HydrophobicContact CD2-CE1 3.45Å; F212-F214 VanDerWaalsContact CD2-CE1 3.45Å; F212-F214 HydrophobicContact CD2-CZ 4.49Å; F212-F214 AromaticContact CE2-CE1 3.95Å; F212-F214 HydrophobicContact CE2-CE1 3.95Å; F212-F214 HydrophobicContact CG-CE1 4.27Å
215	E	94.6	Very high	95.1	Very high	56 Å²	56	48.4 Å²	48.4	26%	0.262	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.8	177.5	-74.1	177.6	-130.9	0	0	111.3	T40 R42 L139 C144 L145	T40-E215 WeakPolarHBondContact CB-OE1 3.21Å; T40-E215 HydrophobicContact CG2-CG 4.09Å; T40-E215 PolarHBondContact OG1-OE1 2.85Å; R42-E215 WeakPolarHBondContact CB-OE1 3.19Å; R42-E215 IonicContact CZ-OE2 3.74Å; R42-E215 IonicContact NH1-OE2 3.33Å; R42-E215 PolarHBondContact NH1-OE2 2.96Å; L139-E215 HydrophobicContact CD1-CG 4.32Å; C144-E215 CarbonylContact O-C 3.58Å; C144-E215 WeakPolarHBondContact O-CA 3.15Å; L145-E215 HydrophobicContact CD1-CG 4.04Å
216	D	96.5	Very high	95.4	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.4	171.4	-167.2	-59.6	0	0	0	110	C144 I146 R194 Q218 L219	C144-D216 PolarHBondContact N-O 2.92Å; C144-D216 PolarHBondContact O-N 3.18Å; I146-D216 HydrophobicContact CD1-CB 3.94Å; R194-D216 IonicContact CZ-OD1 3.82Å; R194-D216 IonicContact CZ-OD2 3.38Å; R194-D216 IonicContact NH1-OD1 3.84Å; R194-D216 IonicContact NH1-OD2 3.31Å; R194-D216 PolarHBondContact NH1-OD2 3.32Å; R194-D216 IonicContact NH2-OD1 3.18Å; R194-D216 PolarHBondContact NH2-OD1 2.87Å; R194-D216 IonicContact NH2-OD2 3.6Å; R194-D216 PolarHBondContact NH2-OD2 3.21Å; D216-Q218 WeakPolarHBondContact OD1-CA 3.03Å; D216-Q218 PolarHBondContact OD1-N 3.03Å; D216-L219 HydrophobicContact CB-CB 3.9Å; D216-L219 PolarHBondContact OD1-N 2.77Å
217	R	95.1	Very high	95.6	Very high	171 Å²	171	46.5 Å²	46.5	65%	0.645	22%	0.224	S	C	*	.	S	Bend	trans	-96.4	-20.8	-177.5	-57.3	-176.7	72.4	160	2.4	114.3	E142 D143 K220	E142-R217 CarbonylContact O-C 3.36Å; E142-R217 WeakPolarHBondContact O-CA 3.36Å; D143-R217 IonicContact OD1-NE 2.61Å; R217-K220 PolarHBondContact O-NZ 2.93Å
218	Q	95.9	Very high	95.9	Very high	49 Å²	49	40.7 Å²	40.7	23%	0.229	19%	0.193	C	C	.	.	S	Bend	trans	-92.3	-33.5	178.2	-61	-167.1	46.7	0	0	111.6	D191 D216	D191-Q218 PolarHBondContact O-NE2 2.82Å; D216-Q218 WeakPolarHBondContact OD1-CA 3.03Å; D216-Q218 PolarHBondContact OD1-N 3.03Å
219	L	97.1	Very high	96.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.19	C	C	.	.			trans	-72.2	130.7	178.7	-157.4	82.2	0	0	0	110.6	F136 C144 I146 V162 V196 L199 D216 V224	F136-L219 HydrophobicContact CD1-CD2 3.86Å; F136-L219 HydrophobicContact CE1-CD2 3.74Å; C144-L219 WeakPolarHBondContact CB-O 2.98Å; I146-L219 HydrophobicContact CD1-CD2 3.94Å; I146-L219 HydrophobicContact CG1-CD2 4.43Å; V162-L219 HydrophobicContact CG2-CD1 4.03Å; V196-L219 HydrophobicContact CG1-CD1 4.1Å; V196-L219 VanDerWaalsContact O-CD1 3.31Å; V196-L219 WeakPolarHBondContact O-CD1 3.4Å; L199-L219 HydrophobicContact CD2-CD1 4.46Å; L199-L219 HydrophobicContact CD2-CD2 4.19Å; D216-L219 HydrophobicContact CB-CB 3.9Å; D216-L219 PolarHBondContact OD1-N 2.77Å; L219-V224 HydrophobicContact CD1-CG1 3.73Å; L219-V224 HydrophobicContact CG-CG1 4.11Å
220	K	97.3	Very high	96.4	Very high	26 Å²	26	35.5 Å²	35.5	11%	0.113	17%	0.171	C	C	.	.			trans	-124.4	136.7	173.3	-47.7	-63	-179.6	-167.2	0	110.5	E141 E142 R217 W222 D223 V224	E141-K220 WeakPolarHBondContact O-CD 3.49Å; E141-K220 WeakPolarHBondContact O-CE 3.38Å; E141-K220 PolarHBondContact O-NZ 2.9Å; E142-K220 PolarHBondContact O-NZ 2.98Å; E142-K220 VanDerWaalsContact O-NZ 3.11Å; E142-K220 IonicContact OE2-NZ 3.66Å; E142-K220 PolarHBondContact OE2-NZ 3.07Å; E142-K220 VanDerWaalsContact OE2-NZ 3.09Å; R217-K220 PolarHBondContact O-NZ 2.93Å; K220-W222 VanDerWaalsContact C-N 3.33Å; K220-W222 HydrophobicContact CB-CD2 4.05Å; K220-W222 VanDerWaalsContact CB-CE2 3.45Å; K220-W222 HydrophobicContact CB-CG 4.47Å; K220-W222 HydrophobicContact CB-CH2 4.35Å; K220-W222 HydrophobicContact CB-CZ2 3.61Å; K220-W222 HydrophobicContact CD-CH2 4.35Å; K220-W222 HydrophobicContact CD-CZ2 3.83Å; K220-W222 HydrophobicContact CG-CZ2 3.73Å; K220-W222 PolarHBondContact O-N 3.28Å; K220-D223 HydrophobicContact CB-CB 4.38Å; K220-D223 PolarHBondContact O-N 3.2Å; K220-D223 VanDerWaalsContact O-N 3.11Å; K220-V224 WeakPolarHBondContact O-CG2 3.27Å; K220-V224 PolarHBondContact O-N 3.48Å
221	V	96.6	Very high	96.6	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-56.9	-44.2	-176.5	173.4	0	0	0	0	112.2	A120 F136 Q138 D223 V224 I225	A120-V221 HydrophobicContact CB-CG1 3.82Å; F136-V221 HydrophobicContact CB-CG2 3.94Å; Q138-V221 HydrophobicContact CB-CB 4.31Å; Q138-V221 HydrophobicContact CB-CG2 3.89Å; V221-D223 VanDerWaalsContact C-N 3.26Å; V221-D223 PolarHBondContact O-N 3.28Å; V221-V224 WeakPolarHBondContact O-CG2 3.4Å; V221-V224 PolarHBondContact O-N 2.82Å; V221-I225 HydrophobicContact CG1-CD1 4Å; V221-I225 HydrophobicContact CG1-CG1 4.32Å; V221-I225 WeakPolarHBondContact O-CG1 3.5Å; V221-I225 PolarHBondContact O-N 2.79Å
222	W	95.9	Very high	96.9	Very high	119 Å²	119	33.1 Å²	33.1	45%	0.451	15%	0.154	S	C	.	.	H	α-helix	trans	-66.5	-25.1	-178.7	51.2	79.3	0	0	0	113.9	Q138 K220	Q138-W222 HydrophobicContact CB-CZ3 4.37Å; Q138-W222 HydrophobicContact CG-CE3 4.49Å; Q138-W222 HydrophobicContact CG-CH2 3.91Å; Q138-W222 HydrophobicContact CG-CZ3 3.58Å; K220-W222 VanDerWaalsContact C-N 3.33Å; K220-W222 HydrophobicContact CB-CD2 4.05Å; K220-W222 VanDerWaalsContact CB-CE2 3.45Å; K220-W222 HydrophobicContact CB-CG 4.47Å; K220-W222 HydrophobicContact CB-CH2 4.35Å; K220-W222 HydrophobicContact CB-CZ2 3.61Å; K220-W222 HydrophobicContact CD-CH2 4.35Å; K220-W222 HydrophobicContact CD-CZ2 3.83Å; K220-W222 HydrophobicContact CG-CZ2 3.73Å; K220-W222 PolarHBondContact O-N 3.28Å
223	D	97.5	Very high	97	Very high	79 Å²	79	34.2 Å²	34.2	42%	0.422	16%	0.164	S	C	.	.	H	α-helix	trans	-83.6	-18	-179.8	-69.3	-35.3	0	0	0	113	K220 V221 R227	K220-D223 HydrophobicContact CB-CB 4.38Å; K220-D223 PolarHBondContact O-N 3.2Å; K220-D223 VanDerWaalsContact O-N 3.11Å; V221-D223 VanDerWaalsContact C-N 3.26Å; V221-D223 PolarHBondContact O-N 3.28Å; D223-R227 PolarHBondContact O-NE 3.02Å
224	V	98.1	Very high	97.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-111.3	-10.3	-174.5	-57.5	0	0	0	0	114.3	V162 F179 L219 K220 V221 G226 R227 I261	V162-V224 HydrophobicContact CG1-CB 4.3Å; V162-V224 HydrophobicContact CG1-CG1 4.1Å; F179-V224 HydrophobicContact CD1-CG1 4.21Å; F179-V224 HydrophobicContact CE1-CG1 4.2Å; L219-V224 HydrophobicContact CD1-CG1 3.73Å; L219-V224 HydrophobicContact CG-CG1 4.11Å; K220-V224 WeakPolarHBondContact O-CG2 3.27Å; K220-V224 PolarHBondContact O-N 3.48Å; V221-V224 WeakPolarHBondContact O-CG2 3.4Å; V221-V224 PolarHBondContact O-N 2.82Å; V224-G226 PolarHBondContact O-N 2.83Å; V224-R227 VanDerWaalsContact O-CB 3.22Å; V224-R227 WeakPolarHBondContact O-CB 3.46Å; V224-R227 PolarHBondContact O-N 2.75Å; V224-I261 HydrophobicContact CB-CD1 3.97Å; V224-I261 HydrophobicContact CG2-CD1 4.14Å; V224-I261 HydrophobicContact CG2-CG2 4.13Å
225	I	98.1	Very high	97.3	Very high	46 Å²	46	40.3 Å²	40.3	24%	0.236	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	128	172.1	-75.3	160.6	0	0	0	109.9	A120 V221 R227 R263	A120-I225 HydrophobicContact CB-CG1 4.26Å; V221-I225 HydrophobicContact CG1-CD1 4Å; V221-I225 HydrophobicContact CG1-CG1 4.32Å; V221-I225 WeakPolarHBondContact O-CG1 3.5Å; V221-I225 PolarHBondContact O-N 2.79Å; I225-R227 VanDerWaalsContact C-N 3.32Å; I225-R263 HydrophobicContact CD1-CG 3.89Å; I225-R263 HydrophobicContact CG1-CG 4.3Å; I225-R263 HydrophobicContact CG2-CG 3.91Å
226	G	97.8	Very high	97.4	Very high	44 Å²	44	37.7 Å²	37.7	45%	0.454	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	-2.3	-177.4	0	0	0	0	0	114.6	G166 V224 I261	G166-G226 VanDerWaalsContact CA-O 3.27Å; G166-G226 WeakPolarHBondContact CA-O 3.43Å; G166-G226 PolarHBondContact N-O 3.49Å; V224-G226 PolarHBondContact O-N 2.83Å; G226-I261 PolarHBondContact N-O 2.81Å
227	R	98.6	Very high	97.5	Very high	68 Å²	68	39 Å²	39	26%	0.257	19%	0.193	S	C	.	.	S	Bend	trans	-87.7	-179.7	167.6	-60.1	-167.8	-170.1	-79	-1.2	110.6	V162 H163 T164 F179 D223 V224 I225 I260 I261	V162-R227 HydrophobicContact CG1-CB 4.08Å; H163-R227 WeakPolarHBondContact O-CB 3.49Å; T164-R227 PolarHBondContact O-NH1 3.32Å; F179-R227 VanDerWaalsContact CD2-CZ 3.48Å; D223-R227 PolarHBondContact O-NE 3.02Å; V224-R227 VanDerWaalsContact O-CB 3.22Å; V224-R227 WeakPolarHBondContact O-CB 3.46Å; V224-R227 PolarHBondContact O-N 2.75Å; I225-R227 VanDerWaalsContact C-N 3.32Å; R227-I260 CarbonylContact O-C 3.48Å; R227-I260 WeakPolarHBondContact O-CA 3.48Å; R227-I261 PolarHBondContact O-N 3.02Å
228	S	98.5	Very high	97.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.9	175.5	60.1	0	0	0	0	112.1	V162 H163 L165 C175 G259	V162-S228 CarbonylContact C-O 3.53Å; V162-S228 WeakPolarHBondContact CA-O 3.26Å; H163-S228 WeakPolarHBondContact CB-OG 3.31Å; H163-S228 PolarHBondContact N-O 2.92Å; L165-S228 WeakPolarHBondContact O-CB 3.28Å; L165-S228 PolarHBondContact O-OG 3.49Å; C175-S228 VanDerWaalsContact CB-OG 3.28Å; C175-S228 WeakPolarHBondContact CB-OG 3.31Å; C175-S228 PolarHBondContact SG-OG 3.13Å; C175-S228 VanDerWaalsContact SG-OG 3.35Å; S228-G259 CarbonylContact C-O 3.55Å; S228-G259 VanDerWaalsContact CA-O 3.24Å; S228-G259 WeakPolarHBondContact CA-O 3.27Å
229	L	98.8	Very high	97.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	137.9	162.5	-176.7	69.6	0	0	0	108	A122 L124 V134 F136 L160 V162 L199 C258 G259 I261	A122-L229 HydrophobicContact CB-CB 3.88Å; A122-L229 HydrophobicContact CB-CD2 4.02Å; L124-L229 HydrophobicContact CD1-CD2 4.28Å; L124-L229 HydrophobicContact CD2-CB 4.02Å; L124-L229 HydrophobicContact CD2-CD2 4.11Å; L124-L229 HydrophobicContact CD2-CG 4.13Å; L124-L229 VanDerWaalsContact CD2-O 3.3Å; L124-L229 WeakPolarHBondContact CD2-O 3.03Å; L124-L229 HydrophobicContact CG-CD2 4.49Å; V134-L229 HydrophobicContact CB-CD2 3.46Å; V134-L229 VanDerWaalsContact CB-CD2 3.46Å; V134-L229 HydrophobicContact CG1-CD2 3.66Å; V134-L229 HydrophobicContact CG2-CD2 3.56Å; F136-L229 HydrophobicContact CE2-CD2 4.36Å; F136-L229 HydrophobicContact CZ-CD1 4.19Å; F136-L229 HydrophobicContact CZ-CD2 4Å; L160-L229 HydrophobicContact CD1-CD1 4.04Å; L160-L229 HydrophobicContact CD1-CD2 4.27Å; L160-L229 HydrophobicContact CD1-CG 4.09Å; L160-L229 HydrophobicContact CD2-CD1 4.32Å; L160-L229 HydrophobicContact CG-CD1 3.95Å; V162-L229 HydrophobicContact CG2-CD1 4.01Å; L199-L229 HydrophobicContact CD1-CD1 3.91Å; L229-C258 CarbonylContact O-C 3.59Å; L229-C258 WeakPolarHBondContact O-CA 3.21Å; L229-G259 PolarHBondContact N-O 2.77Å; L229-G259 PolarHBondContact O-N 2.69Å; L229-I261 HydrophobicContact CB-CD1 4.35Å; L229-I261 HydrophobicContact CB-CG1 4.15Å
230	V	98.5	Very high	97.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.2	-178.4	-174.7	0	0	0	0	109.2	L160 H161 H163 C175 R255 A257 C258	L160-V230 WeakPolarHBondContact CA-O 3.25Å; L160-V230 WeakPolarHBondContact CD1-O 3.45Å; H161-V230 PolarHBondContact N-O 2.86Å; H161-V230 PolarHBondContact O-N 3.41Å; H163-V230 HydrophobicContact CB-CG2 4.24Å; H163-V230 WeakPolarHBondContact CD2-CG2 3.37Å; C175-V230 HydrophobicContact CB-CG2 4.32Å; V230-R255 HydrophobicContact CG1-CB 3.73Å; V230-R255 HydrophobicContact CG1-CG 3.81Å; V230-A257 WeakPolarHBondContact CA-O 3.44Å; V230-C258 HydrophobicContact CG2-CB 3.9Å
231	V	98.4	Very high	97.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133	168.4	59.9	0	0	0	0	109.2	L124 I150 L153 H158 G159 L160 L256 A257	L124-V231 HydrophobicContact CD1-CG1 4.25Å; I150-V231 HydrophobicContact CD1-CB 4.14Å; I150-V231 HydrophobicContact CD1-CG1 4.34Å; I150-V231 HydrophobicContact CD1-CG2 4.17Å; L153-V231 HydrophobicContact CD1-CG2 4.37Å; L153-V231 HydrophobicContact CD2-CG2 4.2Å; H158-V231 HydrophobicContact CB-CG2 3.9Å; G159-V231 WeakPolarHBondContact O-CA 3.09Å; L160-V231 HydrophobicContact CD1-CB 4.04Å; V231-L256 WeakPolarHBondContact O-CB 3.49Å; V231-L256 PolarHBondContact O-N 3.29Å; V231-A257 HydrophobicContact CG1-CB 3.77Å; V231-A257 PolarHBondContact N-O 3.24Å; V231-A257 PolarHBondContact O-N 3.33Å
232	D	97.9	Very high	97.3	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.027	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	168.1	-173.9	-70.9	-18.2	0	0	0	112.9	H158 G159 H161 S252 D254	H158-D232 PolarHBondContact ND1-O 2.75Å; G159-D232 PolarHBondContact O-N 3.46Å; H161-D232 IonicContact CE1-OD2 3.51Å; H161-D232 PolarHBondContact CE1-OD2 2.86Å; H161-D232 VanDerWaalsContact CE1-OD2 3.32Å; H161-D232 IonicContact ND1-OD2 3.07Å; H161-D232 PolarHBondContact ND1-OD2 2.76Å; D232-S252 VanDerWaalsContact OD2-CB 3.24Å; D232-S252 WeakPolarHBondContact OD2-CB 3.39Å; D232-S252 PolarHBondContact OD2-OG 3.28Å; D232-D254 CarbonylContact C-O 3.47Å; D232-D254 WeakPolarHBondContact CA-O 3.47Å
233	S	96.8	Very high	97.4	Very high	39 Å²	39	41 Å²	41	27%	0.273	25%	0.246	S	C	.	.	S	Bend	trans	-74.3	-26.7	-173.1	66	0	0	0	0	114.8	H158 S252 D254	H158-S233 PolarHBondContact CE1-O 3.5Å; H158-S233 PolarHBondContact ND1-O 3.46Å; S233-S252 PolarHBondContact OG-O 2.54Å; S233-D254 WeakPolarHBondContact CB-O 3.1Å; S233-D254 PolarHBondContact N-O 3.4Å; S233-D254 PolarHBondContact OG-N 3.26Å; S233-D254 PolarHBondContact OG-O 2.91Å
234	G	96.1	Very high	97.3	Very high	22 Å²	22	41.8 Å²	41.8	23%	0.227	26%	0.258	C	S	.	.	S	Bend	trans	-140.9	-172	-176.4	0	0	0	0	0	113	P157 H158 G159 S252	P157-G234 CarbonylContact O-C 3.43Å; H158-G234 WeakPolarHBondContact CA-O 3.47Å; G159-G234 PolarHBondContact N-O 3.31Å; G234-S252 WeakPolarHBondContact CA-O 3.35Å; G234-S252 PolarHBondContact N-O 3.32Å
235	E	98.4	Very high	97.2	Very high	119 Å²	119	45.1 Å²	45.1	56%	0.556	28%	0.275	S	S	*	.			trans	-68.3	131	-177.3	-165.5	174.3	153.9	0	0	111.8	P157 S252	P157-E235 HydrophobicContact CB-CB 4.26Å; P157-E235 HydrophobicContact CB-CG 3.96Å; P157-E235 HydrophobicContact CG-CB 3.81Å; P157-E235 HydrophobicContact CG-CG 3.75Å; P157-E235 WeakPolarHBondContact CG-OE2 3.47Å; P157-E235 PolarHBondContact O-N 2.89Å; E235-S252 WeakPolarHBondContact O-CA 3.3Å
236	D	98.3	Very high	97.1	Very high	0 Å²	0	43 Å²	43	0%	0	27%	0.265	C	S	.	.			trans	-74.3	118.3	162.6	-176.5	-22.4	0	0	0	109.4	H161 H186 N201 L238 G250	H161-D236 IonicContact CD2-OD2 3.06Å; H161-D236 IonicContact CE1-OD2 2.86Å; H161-D236 IonicContact NE2-OD2 3.73Å; H161-D236 PolarHBondContact NE2-OD2 3.18Å; H186-D236 IonicContact CD2-OD1 2.72Å; H186-D236 IonicContact CE1-OD1 3.18Å; H186-D236 IonicContact CE1-OD2 2.67Å; H186-D236 PolarHBondContact CE1-OD2 3.08Å; H186-D236 VanDerWaalsContact NE2-CG 3.27Å; H186-D236 IonicContact NE2-OD1 3.42Å; H186-D236 PolarHBondContact NE2-OD1 2.85Å; H186-D236 IonicContact NE2-OD2 3.77Å; H186-D236 PolarHBondContact NE2-OD2 3.21Å; N201-D236 PolarHBondContact ND2-O 2.97Å; N201-D236 WeakPolarHBondContact OD1-CB 3.33Å; N201-D236 PolarHBondContact OD1-N 2.82Å; D236-L238 HydrophobicContact CB-CD2 4.18Å; D236-L238 WeakPolarHBondContact O-CG 3.24Å; D236-L238 PolarHBondContact O-N 2.78Å; D236-L238 VanDerWaalsContact O-N 3.15Å; D236-L238 WeakPolarHBondContact OD1-CA 3.4Å; D236-L238 PolarHBondContact OD1-N 2.84Å; D236-G250 VanDerWaalsContact OD1-CA 3.22Å; D236-G250 WeakPolarHBondContact OD1-CA 3.41Å
237	D	97.9	Very high	97	Very high	31 Å²	31	45.6 Å²	45.6	17%	0.166	26%	0.263	C	S	.	.			trans	-72.1	0.3	178.2	76.8	35.6	0	0	0	114.2	G239 R240 G241 S246 G250	D237-G239 PolarHBondContact O-N 3.05Å; D237-G239 VanDerWaalsContact OD1-CA 3.26Å; D237-G239 WeakPolarHBondContact OD1-CA 3.43Å; D237-G239 PolarHBondContact OD1-N 3.46Å; D237-R240 WeakPolarHBondContact O-CB 3.3Å; D237-R240 PolarHBondContact O-N 3.13Å; D237-R240 PolarHBondContact OD1-N 2.88Å; D237-R240 VanDerWaalsContact OD1-N 3.15Å; D237-G241 VanDerWaalsContact CG-N 3.34Å; D237-G241 PolarHBondContact OD1-N 2.72Å; D237-G241 WeakPolarHBondContact OD2-CA 3.42Å; D237-G241 PolarHBondContact OD2-N 3.25Å; D237-S246 VanDerWaalsContact OD1-CB 3.31Å; D237-S246 WeakPolarHBondContact OD1-CB 3.26Å; D237-S246 PolarHBondContact OD1-OG 2.91Å; D237-S246 VanDerWaalsContact OD2-CB 3.23Å; D237-S246 WeakPolarHBondContact OD2-CB 3.27Å; D237-S246 PolarHBondContact OD2-OG 3.39Å; D237-G250 PolarHBondContact N-O 3.4Å
238	L	97.7	Very high	96.9	Very high	34 Å²	34	47.2 Å²	47.2	18%	0.178	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	28.9	177.1	-47.4	179.9	0	0	0	113.1	D236 R240	D236-L238 HydrophobicContact CB-CD2 4.18Å; D236-L238 WeakPolarHBondContact O-CG 3.24Å; D236-L238 PolarHBondContact O-N 2.78Å; D236-L238 VanDerWaalsContact O-N 3.15Å; D236-L238 WeakPolarHBondContact OD1-CA 3.4Å; D236-L238 PolarHBondContact OD1-N 2.84Å; L238-R240 VanDerWaalsContact C-N 3.32Å; L238-R240 PolarHBondContact O-NH1 3.21Å
239	G	96.7	Very high	96.8	Very high	5 Å²	5	48.6 Å²	48.6	5%	0.052	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	17.4	-177.1	0	0	0	0	0	114	H186 D237 S246 K247	H186-G239 PolarHBondContact CD2-N 3.24Å; D237-G239 PolarHBondContact O-N 3.05Å; D237-G239 VanDerWaalsContact OD1-CA 3.26Å; D237-G239 WeakPolarHBondContact OD1-CA 3.43Å; D237-G239 PolarHBondContact OD1-N 3.46Å; G239-S246 VanDerWaalsContact CA-O 3.26Å; G239-S246 WeakPolarHBondContact CA-O 3.33Å; G239-K247 VanDerWaalsContact O-CE 3.31Å; G239-K247 WeakPolarHBondContact O-CE 3.48Å; G239-K247 PolarHBondContact O-NZ 3.33Å
240	R	96.7	Very high	96.7	Very high	149 Å²	149	48.6 Å²	48.6	56%	0.562	29%	0.285	S	S	*	.			trans	-116.5	-3.3	-173.8	-57.2	176.7	176.1	87.2	1.4	113.3	D191 D237 L238 G242	D191-R240 IonicContact OD1-NH2 2.83Å; D191-R240 PolarHBondContact OD1-NH2 3.12Å; D191-R240 IonicContact OD2-CZ 3.4Å; D191-R240 IonicContact OD2-NH1 2.79Å; D191-R240 PolarHBondContact OD2-NH1 3.18Å; D191-R240 IonicContact OD2-NH2 2.84Å; D191-R240 PolarHBondContact OD2-NH2 2.51Å; D237-R240 WeakPolarHBondContact O-CB 3.3Å; D237-R240 PolarHBondContact O-N 3.13Å; D237-R240 PolarHBondContact OD1-N 2.88Å; D237-R240 VanDerWaalsContact OD1-N 3.15Å; L238-R240 VanDerWaalsContact C-N 3.32Å; L238-R240 PolarHBondContact O-NH1 3.21Å; R240-G242 VanDerWaalsContact C-N 3.34Å; R240-G242 PolarHBondContact O-N 3.31Å
241	G	93.6	Very high	96.7	Very high	50 Å²	50	51.9 Å²	51.9	52%	0.515	30%	0.302	S	S	.	.	S	Bend	trans	-75.8	-12.4	-175.6	0	0	0	0	0	116	D237 H243	D237-G241 VanDerWaalsContact CG-N 3.34Å; D237-G241 PolarHBondContact OD1-N 2.72Å; D237-G241 WeakPolarHBondContact OD2-CA 3.42Å; D237-G241 PolarHBondContact OD2-N 3.25Å; G241-H243 PolarHBondContact O-N 2.8Å
242	G	94.1	Very high	96.6	Very high	80 Å²	80	52 Å²	52	83%	0.825	30%	0.303	S	S	*	.			trans	71.9	9.2	-179.5	0	0	0	0	0	114.7	R240 S246	R240-G242 VanDerWaalsContact C-N 3.34Å; R240-G242 PolarHBondContact O-N 3.31Å; G242-S246 PolarHBondContact N-OG 2.93Å
243	H	96.4	Very high	96.5	Very high	91 Å²	91	54.3 Å²	54.3	42%	0.421	33%	0.329	S	S	.	.	S	Bend	trans	-83.6	158	172	-169.8	-112.4	0	0	0	110.7	G241 L245 S246 N251	G241-H243 PolarHBondContact O-N 2.8Å; H243-L245 PolarHBondContact ND1-N 2.85Å; H243-L245 PolarHBondContact O-N 3.27Å; H243-S246 WeakPolarHBondContact CA-OG 3.48Å; H243-S246 WeakPolarHBondContact CB-OG 3.45Å; H243-S246 PolarHBondContact N-OG 3.18Å; H243-S246 WeakPolarHBondContact O-CB 3.48Å; H243-S246 PolarHBondContact O-N 2.99Å; H243-S246 PolarHBondContact O-OG 3.1Å; H243-N251 PolarHBondContact CE1-OD1 3.06Å; H243-N251 PolarHBondContact ND1-OD1 3.28Å
244	S	95.9	Very high	96.5	Very high	95 Å²	95	58.6 Å²	58.6	66%	0.664	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.4	177.3	55.1	0	0	0	0	112.4
245	L	96.2	Very high	96.5	Very high	70 Å²	70	60.7 Å²	60.7	37%	0.366	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.1	176.8	-58.9	178.5	0	0	0	113.7	H243 K247 L248 T249 G250 N251	H243-L245 PolarHBondContact ND1-N 2.85Å; H243-L245 PolarHBondContact O-N 3.27Å; L245-K247 VanDerWaalsContact C-N 3.3Å; L245-K247 PolarHBondContact O-N 2.76Å; L245-L248 HydrophobicContact CD2-CD1 4.33Å; L245-L248 PolarHBondContact O-N 3.46Å; L245-T249 PolarHBondContact O-N 2.79Å; L245-G250 PolarHBondContact O-N 3.29Å; L245-N251 HydrophobicContact CB-CB 4.26Å
246	S	96.3	Very high	96.4	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.014	33%	0.333	C	S	.	.	H	α-helix	trans	-56	-45.5	-177.5	-60.8	0	0	0	0	111.4	H186 D237 G239 G242 H243 L248 G250	H186-S246 PolarHBondContact CD2-O 3.42Å; H186-S246 VanDerWaalsContact CD2-O 3.23Å; D237-S246 VanDerWaalsContact OD1-CB 3.31Å; D237-S246 WeakPolarHBondContact OD1-CB 3.26Å; D237-S246 PolarHBondContact OD1-OG 2.91Å; D237-S246 VanDerWaalsContact OD2-CB 3.23Å; D237-S246 WeakPolarHBondContact OD2-CB 3.27Å; D237-S246 PolarHBondContact OD2-OG 3.39Å; G239-S246 VanDerWaalsContact CA-O 3.26Å; G239-S246 WeakPolarHBondContact CA-O 3.33Å; G242-S246 PolarHBondContact N-OG 2.93Å; H243-S246 WeakPolarHBondContact CA-OG 3.48Å; H243-S246 WeakPolarHBondContact CB-OG 3.45Å; H243-S246 PolarHBondContact N-OG 3.18Å; H243-S246 WeakPolarHBondContact O-CB 3.48Å; H243-S246 PolarHBondContact O-N 2.99Å; H243-S246 PolarHBondContact O-OG 3.1Å; S246-L248 VanDerWaalsContact C-N 3.26Å; S246-L248 PolarHBondContact O-N 3.3Å; S246-G250 WeakPolarHBondContact O-CA 3.34Å; S246-G250 PolarHBondContact O-N 2.91Å
247	K	96.2	Very high	96.4	Very high	97 Å²	97	56.9 Å²	56.9	42%	0.422	33%	0.333	S	S	.	.	H	α-helix	trans	-79.2	-2.1	179.9	-65.4	-53.1	-164.9	-172	0	114.9	H186 G239 L245	H186-K247 VanDerWaalsContact CB-O 3.27Å; H186-K247 WeakPolarHBondContact CB-O 3.4Å; H186-K247 PolarHBondContact N-O 3.35Å; G239-K247 VanDerWaalsContact O-CE 3.31Å; G239-K247 WeakPolarHBondContact O-CE 3.48Å; G239-K247 PolarHBondContact O-NZ 3.33Å; L245-K247 VanDerWaalsContact C-N 3.3Å; L245-K247 PolarHBondContact O-N 2.76Å
248	L	95.9	Very high	96.4	Very high	103 Å²	103	55.7 Å²	55.7	54%	0.539	33%	0.327	S	S	.	.	H	α-helix	trans	-112	-47.3	-177.8	-63.1	177.3	0	0	0	112.4	H195 L245 S246	H195-L248 PolarHBondContact CE1-O 3.43Å; H195-L248 VanDerWaalsContact CE1-O 3.29Å; L245-L248 HydrophobicContact CD2-CD1 4.33Å; L245-L248 PolarHBondContact O-N 3.46Å; S246-L248 VanDerWaalsContact C-N 3.26Å; S246-L248 PolarHBondContact O-N 3.3Å
249	T	96.5	Very high	96.4	Very high	29 Å²	29	54.1 Å²	54.1	18%	0.178	32%	0.319	C	S	.	.	H	α-helix	trans	-135.3	-1.2	-174.5	69.2	0	0	0	0	113.2	L245 N251 S252	L245-T249 PolarHBondContact O-N 2.79Å; T249-N251 PolarHBondContact O-N 2.92Å; T249-N251 PolarHBondContact OG1-N 3.4Å; T249-S252 PolarHBondContact O-OG 3.3Å
250	G	97.2	Very high	96.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	8.2	-171.9	0	0	0	0	0	114.3	H186 D236 D237 L245 S246 S252	H186-G250 VanDerWaalsContact CD2-CA 3.45Å; H186-G250 WeakPolarHBondContact CD2-CA 3.38Å; H186-G250 PolarHBondContact CD2-N 2.88Å; H186-G250 VanDerWaalsContact CD2-N 3.33Å; H186-G250 VanDerWaalsContact NE2-CA 3.3Å; H186-G250 WeakPolarHBondContact NE2-CA 3.45Å; H186-G250 PolarHBondContact NE2-N 3.17Å; D236-G250 VanDerWaalsContact OD1-CA 3.22Å; D236-G250 WeakPolarHBondContact OD1-CA 3.41Å; D237-G250 PolarHBondContact N-O 3.4Å; L245-G250 PolarHBondContact O-N 3.29Å; S246-G250 WeakPolarHBondContact O-CA 3.34Å; S246-G250 PolarHBondContact O-N 2.91Å; G250-S252 VanDerWaalsContact C-N 3.25Å; G250-S252 PolarHBondContact O-N 3.31Å
251	N	97.4	Very high	96.5	Very high	68 Å²	68	50.2 Å²	50.2	36%	0.364	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	35.1	178	-164.6	59.6	0	0	0	114.3	H243 L245 T249 G253	H243-N251 PolarHBondContact CE1-OD1 3.06Å; H243-N251 PolarHBondContact ND1-OD1 3.28Å; L245-N251 HydrophobicContact CB-CB 4.26Å; T249-N251 PolarHBondContact O-N 2.92Å; T249-N251 PolarHBondContact OG1-N 3.4Å; N251-G253 VanDerWaalsContact C-N 3.27Å; N251-G253 PolarHBondContact O-N 3.25Å
252	S	96.2	Very high	96.7	Very high	3 Å²	3	50 Å²	50	2%	0.021	30%	0.3	C	S	.	.			trans	-76.6	1.1	-176.3	46.6	0	0	0	0	115.8	D232 S233 G234 E235 T249 G250	D232-S252 VanDerWaalsContact OD2-CB 3.24Å; D232-S252 WeakPolarHBondContact OD2-CB 3.39Å; D232-S252 PolarHBondContact OD2-OG 3.28Å; S233-S252 PolarHBondContact OG-O 2.54Å; G234-S252 WeakPolarHBondContact CA-O 3.35Å; G234-S252 PolarHBondContact N-O 3.32Å; E235-S252 WeakPolarHBondContact O-CA 3.3Å; T249-S252 PolarHBondContact O-OG 3.3Å; G250-S252 VanDerWaalsContact C-N 3.25Å; G250-S252 PolarHBondContact O-N 3.31Å
253	G	96.1	Very high	96.7	Very high	54 Å²	54	55.6 Å²	55.6	56%	0.557	30%	0.297	S	S	*	.			trans	83	-144.6	175.6	0	0	0	0	0	114.1	N251	N251-G253 VanDerWaalsContact C-N 3.27Å; N251-G253 PolarHBondContact O-N 3.25Å
254	D	96.3	Very high	96.3	Very high	128 Å²	128	52.6 Å²	52.6	68%	0.684	29%	0.286	S	S	*	.	S	Bend	trans	-79	149.8	-175.5	-67.2	-32.8	0	0	0	112.1	D232 S233 L256	D232-D254 CarbonylContact C-O 3.47Å; D232-D254 WeakPolarHBondContact CA-O 3.47Å; S233-D254 WeakPolarHBondContact CB-O 3.1Å; S233-D254 PolarHBondContact N-O 3.4Å; S233-D254 PolarHBondContact OG-N 3.26Å; S233-D254 PolarHBondContact OG-O 2.91Å; D254-L256 PolarHBondContact O-N 3.22Å
255	R	97.1	Very high	95.5	Very high	66 Å²	66	49.2 Å²	49.2	25%	0.249	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	112.7	176.2	-59.6	175.3	-171.7	179.2	-0.8	109.7	H163 C172 G176 V230	H163-R255 VanDerWaalsContact CE1-CZ 3.41Å; H163-R255 PolarHBondContact CE1-NE 3.45Å; H163-R255 PolarHBondContact CE1-NH2 2.84Å; C172-R255 HydrophobicContact CB-CB 3.63Å; C172-R255 WeakPolarHBondContact O-CD 3.3Å; C172-R255 PolarHBondContact O-NH1 2.96Å; G176-R255 PolarHBondContact O-NH1 2.97Å; G176-R255 PolarHBondContact O-NH2 2.8Å; V230-R255 HydrophobicContact CG1-CB 3.73Å; V230-R255 HydrophobicContact CG1-CG 3.81Å
256	L	96.6	Very high	94.8	Very high	40 Å²	40	46 Å²	46	21%	0.209	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-49.1	-172.7	-69.1	-175.6	0	0	0	113.2	G126 A127 I130 L153 V231 D254	G126-L256 WeakPolarHBondContact CA-O 3.48Å; A127-L256 PolarHBondContact N-O 3.4Å; A127-L256 VanDerWaalsContact N-O 3.16Å; I130-L256 HydrophobicContact CD1-CB 3.75Å; I130-L256 HydrophobicContact CD1-CD1 3.8Å; I130-L256 HydrophobicContact CD1-CD2 4.28Å; I130-L256 HydrophobicContact CD1-CG 4.17Å; L153-L256 HydrophobicContact CD2-CD1 3.87Å; V231-L256 WeakPolarHBondContact O-CB 3.49Å; V231-L256 PolarHBondContact O-N 3.29Å; D254-L256 PolarHBondContact O-N 3.22Å
257	A	97.4	Very high	94	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.4	-177.5	0	0	0	0	0	110.9	L124 I130 V230 V231	L124-A257 HydrophobicContact CB-CB 4.34Å; I130-A257 HydrophobicContact CB-CB 4.29Å; I130-A257 HydrophobicContact CG2-CB 3.6Å; V230-A257 WeakPolarHBondContact CA-O 3.44Å; V231-A257 HydrophobicContact CG1-CB 3.77Å; V231-A257 PolarHBondContact N-O 3.24Å; V231-A257 PolarHBondContact O-N 3.33Å
258	C	97.8	Very high	93.1	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.041	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	159.8	-177.1	46.9	0	0	0	0	111.2	S125 L168 C172 L229 V230	S125-C258 PolarHBondContact N-O 3.07Å; S125-C258 PolarHBondContact O-N 3.45Å; S125-C258 VanDerWaalsContact O-N 3.14Å; L168-C258 HydrophobicContact CD2-CB 4.23Å; C172-C258 WeakPolarHBondContact CA-SG 3.24Å; C172-C258 HydrophobicContact CB-CB 3.75Å; C172-C258 WeakPolarHBondContact CB-SG 3.42Å; C172-C258 PolarHBondContact N-SG 3.14Å; C172-C258 VanDerWaalsContact N-SG 3.37Å; C172-C258 WeakPolarHBondContact SG-CB 3.22Å; C172-C258 PolarHBondContact SG-N 3.29Å; C172-C258 CovalentContact SG-SG 2.05Å; C172-C258 PolarHBondContact SG-SG 3.01Å; L229-C258 CarbonylContact O-C 3.59Å; L229-C258 WeakPolarHBondContact O-CA 3.21Å; V230-C258 HydrophobicContact CG2-CB 3.9Å
259	G	97.6	Very high	92.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	141.5	-179.9	0	0	0	0	0	111.4	M123 S228 L229 I261	M123-G259 VanDerWaalsContact O-CA 3.25Å; M123-G259 WeakPolarHBondContact O-CA 3.5Å; S228-G259 CarbonylContact C-O 3.55Å; S228-G259 VanDerWaalsContact CA-O 3.24Å; S228-G259 WeakPolarHBondContact CA-O 3.27Å; L229-G259 PolarHBondContact N-O 2.77Å; L229-G259 PolarHBondContact O-N 2.69Å; G259-I261 PolarHBondContact O-N 2.81Å
260	I	98.4	Very high	91.2	Very high	71 Å²	71	49.2 Å²	49.2	36%	0.364	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	131.6	174.9	-59.8	169.5	0	0	0	108.7	G166 L168 R227 A262	G166-I260 VanDerWaalsContact O-CD1 3.27Å; G166-I260 WeakPolarHBondContact O-CD1 3.1Å; L168-I260 HydrophobicContact CD1-CD1 4.13Å; L168-I260 HydrophobicContact CD1-CG1 3.9Å; L168-I260 HydrophobicContact CG-CD1 4.26Å; L168-I260 HydrophobicContact CG-CG1 4.03Å; R227-I260 CarbonylContact O-C 3.48Å; R227-I260 WeakPolarHBondContact O-CA 3.48Å; I260-A262 PolarHBondContact O-N 2.87Å; I260-A262 VanDerWaalsContact O-N 3.12Å
261	I	98.4	Very high	89.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	100	171.7	-58.3	168.8	0	0	0	107.4	A120 A122 F136 V162 V224 G226 R227 L229 G259	A120-I261 HydrophobicContact CB-CG2 3.7Å; A122-I261 HydrophobicContact CB-CG1 4.09Å; F136-I261 HydrophobicContact CD2-CG2 4.13Å; F136-I261 HydrophobicContact CE2-CD1 4.34Å; F136-I261 HydrophobicContact CE2-CG1 4.1Å; F136-I261 HydrophobicContact CE2-CG2 4.15Å; F136-I261 HydrophobicContact CZ-CD1 4.14Å; F136-I261 HydrophobicContact CZ-CG1 4.35Å; V162-I261 HydrophobicContact CG1-CD1 3.83Å; V162-I261 HydrophobicContact CG2-CD1 3.96Å; V224-I261 HydrophobicContact CB-CD1 3.97Å; V224-I261 HydrophobicContact CG2-CD1 4.14Å; V224-I261 HydrophobicContact CG2-CG2 4.13Å; G226-I261 PolarHBondContact N-O 2.81Å; R227-I261 PolarHBondContact O-N 3.02Å; L229-I261 HydrophobicContact CB-CD1 4.35Å; L229-I261 HydrophobicContact CB-CG1 4.15Å; G259-I261 PolarHBondContact O-N 2.81Å
262	A	96.6	Very high	88.4	Confident	45 Å²	45	58 Å²	58	37%	0.372	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	156.8	-177.8	0	0	0	0	0	111.4	A120 V121 I260 S264	A120-A262 CarbonylContact C-O 3.59Å; A120-A262 WeakPolarHBondContact CA-O 3.45Å; A120-A262 WeakPolarHBondContact CB-O 3.33Å; V121-A262 PolarHBondContact N-O 3.13Å; V121-A262 PolarHBondContact O-N 3.33Å; I260-A262 PolarHBondContact O-N 2.87Å; I260-A262 VanDerWaalsContact O-N 3.12Å; A262-S264 PolarHBondContact O-N 3.49Å
263	R	94	Very high	86.8	Confident	199 Å²	199	65.2 Å²	65.2	75%	0.751	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61	133.3	172	-66.6	177.1	-178	-88.2	-2.2	109.8	I225	I225-R263 HydrophobicContact CD1-CG 3.89Å; I225-R263 HydrophobicContact CG1-CG 4.3Å; I225-R263 HydrophobicContact CG2-CG 3.91Å
264	S	88.3	Confident	85	Confident	28 Å²	28	66 Å²	66	20%	0.196	33%	0.327	C	S	.	.			trans	-112.8	153.9	172.7	-177.8	0	0	0	0	109.9	A119 A262	A119-S264 PolarHBondContact O-N 3.23Å; A262-S264 PolarHBondContact O-N 3.49Å
265	A	79.3	Confident	83.1	Confident	24 Å²	24	61.2 Å²	61.2	20%	0.198	30%	0.303	C	S	.	.			trans	-65.4	135.4	168.1	0	0	0	0	0	110.1	Q269 N270	A265-Q269 HydrophobicContact CB-CB 3.99Å; A265-N270 HydrophobicContact CB-CB 3.69Å
266	G	80.4	Confident	80.8	Confident	2 Å²	2	63 Å²	63	2%	0.021	33%	0.331	C	S	.	.			trans	-73.8	-169.2	161.6	0	0	0	0	0	111.5	F268 Q269	G266-F268 PolarHBondContact O-N 2.82Å; G266-Q269 PolarHBondContact O-N 3.31Å
267	L	79.8	Confident	78.9	Confident	16 Å²	16	66.1 Å²	66.1	8%	0.084	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	132.6	178.5	-63.7	169.4	0	0	0	111.1	K45 E47 L84 Q269	K45-L267 HydrophobicContact CB-CD1 3.59Å; K45-L267 HydrophobicContact CB-CD2 4.2Å; K45-L267 HydrophobicContact CB-CG 4.49Å; K45-L267 HydrophobicContact CD-CD1 3.8Å; K45-L267 HydrophobicContact CG-CD1 4.36Å; E47-L267 HydrophobicContact CB-CD2 3.78Å; L84-L267 HydrophobicContact CD1-CD2 3.89Å; L267-Q269 PolarHBondContact O-N 2.72Å; L267-Q269 VanDerWaalsContact O-N 3.09Å
268	F	78.8	Confident	76.6	Confident	128 Å²	128	68.9 Å²	68.9	56%	0.561	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	8	177.8	-41.1	-69.1	0	0	0	115.2	E47 L82 L84 G266	E47-F268 WeakPolarHBondContact OE2-CA 3.37Å; E47-F268 PolarHBondContact OE2-N 3.01Å; L82-F268 HydrophobicContact CD2-CD1 4.36Å; L82-F268 HydrophobicContact CD2-CE1 3.94Å; L84-F268 HydrophobicContact CD1-CZ 4.26Å; L84-F268 HydrophobicContact CD2-CZ 4.13Å; G266-F268 PolarHBondContact O-N 2.82Å
269	Q	79	Confident	74.6	Confident	114 Å²	114	70.4 Å²	70.4	53%	0.533	39%	0.387	S	S	.	.			trans	-87.7	-6.6	-177.3	-63.8	177.3	10.5	0	0	113.3	D116 A265 G266 L267 P271	D116-Q269 PolarHBondContact OD2-NE2 2.86Å; D116-Q269 VanDerWaalsContact OD2-NE2 3.08Å; A265-Q269 HydrophobicContact CB-CB 3.99Å; G266-Q269 PolarHBondContact O-N 3.31Å; L267-Q269 PolarHBondContact O-N 2.72Å; L267-Q269 VanDerWaalsContact O-N 3.09Å; Q269-P271 WeakPolarHBondContact O-CD 3.3Å
270	N	73.8	Confident	72.7	Confident	41 Å²	41	70.6 Å²	70.6	22%	0.219	39%	0.388	C	S	.	.			trans	-116.3	91.7	178.5	-170.4	9.1	0	0	0	112.2	K108 A265 K272	K108-N270 WeakPolarHBondContact CE-O 3.49Å; K108-N270 PolarHBondContact NZ-O 3.02Å; A265-N270 HydrophobicContact CB-CB 3.69Å; N270-K272 VanDerWaalsContact C-N 3.28Å; N270-K272 PolarHBondContact O-N 3.03Å; N270-K272 VanDerWaalsContact OD1-CB 3.3Å; N270-K272 WeakPolarHBondContact OD1-CB 3.45Å; N270-K272 WeakPolarHBondContact OD1-CG 3.31Å; N270-K272 PolarHBondContact OD1-N 2.98Å
271	P	68.4	Low	70.9	Confident	110 Å²	110	68.9 Å²	68.9	71%	0.714	38%	0.381	S	S	*	.			trans	-81.3	-3.9	174.9	33.2	-35.6	0	0	0	113.3	Q269 K273	Q269-P271 WeakPolarHBondContact O-CD 3.3Å; P271-K273 PolarHBondContact O-N 3.47Å
272	K	66.9	Low	69.1	Low	142 Å²	142	70 Å²	70	62%	0.617	39%	0.387	S	S	*	.			trans	-63.5	127.3	-174.4	-64.3	-177.5	178.9	179.9	0	110.1	N270 L282	N270-K272 VanDerWaalsContact C-N 3.28Å; N270-K272 PolarHBondContact O-N 3.03Å; N270-K272 VanDerWaalsContact OD1-CB 3.3Å; N270-K272 WeakPolarHBondContact OD1-CB 3.45Å; N270-K272 WeakPolarHBondContact OD1-CG 3.31Å; N270-K272 PolarHBondContact OD1-N 2.98Å; K272-L282 WeakPolarHBondContact O-CD1 3.23Å
273	K	61.8	Low	67.4	Low	155 Å²	155	70.2 Å²	70.2	67%	0.674	38%	0.378	S	S	*	.			trans	-103.2	-20.4	169.9	-66.4	-171.5	176.7	-171.5	0	112.8	P271 T281 L282	P271-K273 PolarHBondContact O-N 3.47Å; K273-T281 WeakPolarHBondContact O-CA 3.38Å; K273-L282 PolarHBondContact O-N 3.34Å
274	I	57.8	Low	65.6	Low	70 Å²	70	65.1 Å²	65.1	36%	0.359	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.4	-173.9	-56.5	173.1	0	0	0	108.7	V280	I274-V280 WeakPolarHBondContact CA-O 3.32Å
275	C	57.3	Low	64.1	Low	28 Å²	28	67.6 Å²	67.6	19%	0.189	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	112.1	173	-83.5	0	0	0	0	110.1	C277 D278 G279 V280 E285	C275-C277 PolarHBondContact O-N 3.34Å; C275-C277 VanDerWaalsContact O-N 3.17Å; C275-D278 PolarHBondContact O-N 3.06Å; C275-G279 PolarHBondContact O-N 2.81Å; C275-V280 HydrophobicContact CB-CG2 4.32Å; C275-V280 PolarHBondContact N-O 2.53Å; C275-E285 PolarHBondContact SG-OE2 2.81Å
276	A	49.5	Very low	63.2	Low	102 Å²	102	71.5 Å²	71.5	84%	0.843	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22	-171.4	0	0	0	0	0	114.6	D278	A276-D278 VanDerWaalsContact C-N 3.34Å; A276-D278 PolarHBondContact O-N 3.27Å
277	C	55	Low	62.2	Low	107 Å²	107	76.4 Å²	76.4	72%	0.723	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-38.6	-179.9	-55.4	0	0	0	0	112.1	C275	C275-C277 PolarHBondContact O-N 3.34Å; C275-C277 VanDerWaalsContact O-N 3.17Å
278	D	50.7	Low	61.1	Low	58 Å²	58	79.5 Å²	79.5	31%	0.31	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-1.4	-170.4	-59.3	-26.6	0	0	0	113.1	C275 A276 V280	C275-D278 PolarHBondContact O-N 3.06Å; A276-D278 VanDerWaalsContact C-N 3.34Å; A276-D278 PolarHBondContact O-N 3.27Å; D278-V280 HydrophobicContact CB-CG1 4.28Å; D278-V280 HydrophobicContact CB-CG2 4.08Å; D278-V280 PolarHBondContact O-N 3.24Å
279	G	54.9	Low	59.8	Low	37 Å²	37	76.7 Å²	76.7	38%	0.381	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	9.6	-178.6	0	0	0	0	0	114.6	C275	C275-G279 PolarHBondContact O-N 2.81Å
280	V	57.6	Low	58.5	Low	6 Å²	6	74.8 Å²	74.8	4%	0.036	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	148.5	-178	-65	0	0	0	0	112	I274 C275 D278 E284 E285	I274-V280 WeakPolarHBondContact CA-O 3.32Å; C275-V280 HydrophobicContact CB-CG2 4.32Å; C275-V280 PolarHBondContact N-O 2.53Å; D278-V280 HydrophobicContact CB-CG1 4.28Å; D278-V280 HydrophobicContact CB-CG2 4.08Å; D278-V280 PolarHBondContact O-N 3.24Å; V280-E284 WeakPolarHBondContact CA-OE2 3.36Å; V280-E284 HydrophobicContact CB-CB 3.91Å; V280-E284 HydrophobicContact CG1-CB 4.32Å; V280-E285 HydrophobicContact CG2-CB 4.25Å
281	T	61.3	Low	57.2	Low	35 Å²	35	76.3 Å²	76.3	22%	0.215	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	158.3	171.2	63.5	0	0	0	0	110.7	K273 W283 E284 E285	K273-T281 WeakPolarHBondContact O-CA 3.38Å; T281-W283 PolarHBondContact O-N 3.48Å; T281-E284 PolarHBondContact N-OE2 3.01Å; T281-E284 PolarHBondContact O-N 2.81Å; T281-E284 WeakPolarHBondContact OG1-CG 3.26Å; T281-E284 PolarHBondContact OG1-N 3.46Å; T281-E284 PolarHBondContact OG1-OE2 2.95Å; T281-E284 VanDerWaalsContact OG1-OE2 3.12Å; T281-E285 PolarHBondContact O-N 2.98Å; T281-E285 VanDerWaalsContact O-N 3.08Å
282	L	60.7	Low	56.3	Low	23 Å²	23	73.5 Å²	73.5	12%	0.12	42%	0.417	C	S	.	.	H	α-helix	trans	-50.5	-29.4	171.7	-76.8	176.4	0	0	0	112.9	K108 K272 K273	K108-L282 HydrophobicContact CD-CD1 4.31Å; K272-L282 WeakPolarHBondContact O-CD1 3.23Å; K273-L282 PolarHBondContact O-N 3.34Å
283	W	61.3	Low	55.3	Low	49 Å²	49	76.7 Å²	76.7	19%	0.186	43%	0.431	C	S	.	.	H	α-helix	trans	-70.5	-42.1	179.1	-50.6	116.4	0	0	0	112.6	A49 Q51 R104 V106 T281	A49-W283 VanDerWaalsContact C-CH2 3.43Å; A49-W283 HydrophobicContact CB-CH2 3.75Å; A49-W283 HydrophobicContact CB-CZ2 4.19Å; A49-W283 HydrophobicContact CB-CZ3 4.45Å; A49-W283 WeakPolarHBondContact O-CH2 3.45Å; A49-W283 WeakPolarHBondContact O-CZ3 3.31Å; Q51-W283 HydrophobicContact CB-CH2 4.01Å; Q51-W283 HydrophobicContact CB-CZ2 4.15Å; Q51-W283 HydrophobicContact CB-CZ3 4.23Å; R104-W283 HydrophobicContact CB-CE3 4.13Å; R104-W283 HydrophobicContact CB-CZ3 4.24Å; R104-W283 PolarHBondContact NH2-O 3.15Å; R104-W283 WeakPolarHBondContact O-CZ3 3.26Å; V106-W283 HydrophobicContact CB-CZ3 4.47Å; V106-W283 HydrophobicContact CG2-CE3 3.82Å; V106-W283 HydrophobicContact CG2-CZ3 3.92Å; T281-W283 PolarHBondContact O-N 3.48Å
284	E	56.3	Low	54.9	Low	92 Å²	92	71.4 Å²	71.4	43%	0.43	42%	0.42	S	S	.	.	H	α-helix	trans	-78.8	-29	-176.7	-70.2	165.3	151.4	0	0	112	V280 T281 R286 D287	V280-E284 WeakPolarHBondContact CA-OE2 3.36Å; V280-E284 HydrophobicContact CB-CB 3.91Å; V280-E284 HydrophobicContact CG1-CB 4.32Å; T281-E284 PolarHBondContact N-OE2 3.01Å; T281-E284 PolarHBondContact O-N 2.81Å; T281-E284 WeakPolarHBondContact OG1-CG 3.26Å; T281-E284 PolarHBondContact OG1-N 3.46Å; T281-E284 PolarHBondContact OG1-OE2 2.95Å; T281-E284 VanDerWaalsContact OG1-OE2 3.12Å; E284-R286 PolarHBondContact O-N 3.15Å; E284-D287 PolarHBondContact O-N 3Å
285	E	55.3	Low	54.5	Low	81 Å²	81	73.4 Å²	73.4	38%	0.379	42%	0.423	S	S	.	.	H	α-helix	trans	-59.4	-35.5	175.6	-173.6	174.5	-161	0	0	112	C275 V280 T281 D287 R288	C275-E285 PolarHBondContact SG-OE2 2.81Å; V280-E285 HydrophobicContact CG2-CB 4.25Å; T281-E285 PolarHBondContact O-N 2.98Å; T281-E285 VanDerWaalsContact O-N 3.08Å; E285-D287 VanDerWaalsContact C-N 3.31Å; E285-D287 PolarHBondContact O-N 2.84Å; E285-R288 PolarHBondContact O-N 2.94Å
286	R	61	Low	54	Low	105 Å²	105	76.8 Å²	76.8	40%	0.396	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-37.9	178.9	179.2	-179.1	171.4	-178.3	-0.8	113.7	E99 A105 E284 R288	E99-R286 VanDerWaalsContact CD-NH1 3.35Å; E99-R286 IonicContact OE1-CZ 2.85Å; E99-R286 IonicContact OE1-NH1 3.74Å; E99-R286 PolarHBondContact OE1-NH1 3.2Å; E99-R286 IonicContact OE1-NH2 3.66Å; E99-R286 PolarHBondContact OE1-NH2 3.4Å; E99-R286 IonicContact OE2-CZ 3.27Å; E99-R286 IonicContact OE2-NH1 2.78Å; E99-R286 IonicContact OE2-NH2 2.9Å; E99-R286 PolarHBondContact OE2-NH2 2.89Å; A105-R286 PolarHBondContact O-NH1 3.26Å; E284-R286 PolarHBondContact O-N 3.15Å; R286-R288 VanDerWaalsContact C-N 3.28Å
287	D	58.7	Low	53.9	Low	106 Å²	106	79.6 Å²	79.6	57%	0.567	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-4.1	-174.2	-61.9	-14.9	0	0	0	111.7	R104 E284 E285	R104-D287 IonicContact CZ-OD1 3.75Å; R104-D287 IonicContact CZ-OD2 3.73Å; R104-D287 VanDerWaalsContact CZ-OD2 3.27Å; R104-D287 IonicContact NH1-OD1 3.31Å; R104-D287 IonicContact NH1-OD2 3.71Å; R104-D287 PolarHBondContact NH1-OD2 2.94Å; R104-D287 IonicContact NH2-OD1 3.32Å; R104-D287 PolarHBondContact NH2-OD1 3.27Å; R104-D287 IonicContact NH2-OD2 2.81Å; R104-D287 PolarHBondContact NH2-OD2 3.22Å; E284-D287 PolarHBondContact O-N 3Å; E285-D287 VanDerWaalsContact C-N 3.31Å; E285-D287 PolarHBondContact O-N 2.84Å
288	R	56.8	Low	53.5	Low	81 Å²	81	81.8 Å²	81.8	31%	0.306	44%	0.444	S	S	.	.	S	Bend	trans	-92.7	138.8	177.4	-72.1	-171.8	179.5	-170.7	2.7	110.6	E285 R286 V290	E285-R288 PolarHBondContact O-N 2.94Å; R286-R288 VanDerWaalsContact C-N 3.28Å; R288-V290 PolarHBondContact O-N 3.29Å
289	P	51	Low	53.2	Low	69 Å²	69	82.7 Å²	82.7	45%	0.448	45%	0.448	S	S	.	.			trans	-60.9	135.6	175.1	24.4	-31.9	0	0	0	110.3	A291	P289-A291 PolarHBondContact O-N 3.31Å; P289-A291 VanDerWaalsContact O-N 3.08Å
290	V	52	Low	52.9	Low	74 Å²	74	86.8 Å²	86.8	45%	0.448	47%	0.468	S	S	.	.	S	Bend	trans	-56	-27.5	-178.2	178.8	0	0	0	0	111.6	M123 R288 R295	M123-V290 HydrophobicContact CE-CG1 3.62Å; M123-V290 HydrophobicContact CE-CG2 4.36Å; R288-V290 PolarHBondContact O-N 3.29Å; V290-R295 PolarHBondContact O-NH1 3.01Å
291	A	46.6	Very low	52.3	Low	73 Å²	73	94.2 Å²	94.2	60%	0.603	50%	0.502	S	S	*	.	S	Bend	trans	-151.2	164.1	169.5	0	0	0	0	0	111.8	P289	P289-A291 PolarHBondContact O-N 3.31Å; P289-A291 VanDerWaalsContact O-N 3.08Å
292	G	50.3	Low	51.4	Low	51 Å²	51	96.4 Å²	96.4	53%	0.526	52%	0.516	S	S	.	.	S	Bend	trans	107.8	-167.1	171	0	0	0	0	0	116.3	G294 R295	G292-G294 PolarHBondContact O-N 2.88Å; G292-R295 PolarHBondContact O-N 3.4Å
293	K	46.4	Very low	50.5	Low	208 Å²	208	99.6 Å²	99.6	90%	0.904	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.7	-169.8	-75.7	-177.5	178.3	176.4	0	115.5
294	G	52.2	Low	49.5	Very low	44 Å²	44	102.4 Å²	102.4	45%	0.454	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	-10.9	175.4	0	0	0	0	0	115.3	G292	G292-G294 PolarHBondContact O-N 2.88Å
295	R	50.6	Low	48.7	Very low	112 Å²	112	100.1 Å²	100.1	42%	0.423	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.9	-33.4	-179.7	-164.4	170.8	-174.9	-179.4	2.3	112.5	V290 G292 K297	V290-R295 PolarHBondContact O-NH1 3.01Å; G292-R295 PolarHBondContact O-N 3.4Å; R295-K297 PolarHBondContact O-N 2.99Å
296	S	46.5	Very low	48	Very low	100 Å²	100	104.2 Å²	104.2	70%	0.699	58%	0.578	S	S	*	*	S	Bend	trans	-90.1	78.5	175.8	174.5	0	0	0	0	111
297	K	45.9	Very low	46.8	Very low	161 Å²	161	110.4 Å²	110.4	70%	0.7	62%	0.618	S	S	*	*			trans	-157.4	104.5	150	-68.2	-159.6	-178.4	178.9	0	109.1	R295 N299	R295-K297 PolarHBondContact O-N 2.99Å; K297-N299 PolarHBondContact O-N 2.94Å
298	I	46.9	Very low	46.2	Very low	153 Å²	153	110.7 Å²	110.7	79%	0.785	62%	0.621	S	S	*	*			trans	-62.5	98.2	144.3	-63.2	171	0	0	0	103.7	P300	I298-P300 VanDerWaalsContact O-CD 3.28Å; I298-P300 WeakPolarHBondContact O-CD 3.44Å
299	N	45.1	Very low	45.7	Very low	76 Å²	76	112.2 Å²	112.2	41%	0.406	64%	0.637	S	S	.	*			trans	-73.7	117	172.3	-161.7	18.4	0	0	0	105.7	K297 E301 T302	K297-N299 PolarHBondContact O-N 2.94Å; N299-E301 PolarHBondContact O-N 3.1Å; N299-T302 PolarHBondContact O-N 3.04Å
300	P	48.3	Very low	45.4	Very low	123 Å²	123	114.6 Å²	114.6	80%	0.799	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-6.1	-177.9	23.7	-32	0	0	0	113.5	I298	I298-P300 VanDerWaalsContact O-CD 3.28Å; I298-P300 WeakPolarHBondContact O-CD 3.44Å
301	E	44.4	Very low	45	Very low	162 Å²	162	117 Å²	117	76%	0.757	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-6	174.8	-63	-174.1	161.6	0	0	114.2	N299 P303	N299-E301 PolarHBondContact O-N 3.1Å; E301-P303 VanDerWaalsContact O-CD 3.27Å; E301-P303 WeakPolarHBondContact O-CD 3.5Å
302	T	43.9	Very low	44.9	Very low	82 Å²	82	119.8 Å²	119.8	50%	0.503	66%	0.663	S	S	.	*	S	Bend	trans	-78.4	114.3	174.6	-50.6	0	0	0	0	108.3	N299	N299-T302 PolarHBondContact O-N 3.04Å
303	P	40.1	Very low	44.5	Very low	90 Å²	90	124.3 Å²	124.3	58%	0.584	67%	0.672	S	S	*	*			trans	-57.4	141.6	174.6	-16	28.9	0	0	0	108.3	E301 A305	E301-P303 VanDerWaalsContact O-CD 3.27Å; E301-P303 WeakPolarHBondContact O-CD 3.5Å; P303-A305 PolarHBondContact O-N 2.98Å; P303-A305 VanDerWaalsContact O-N 3.12Å
304	P	41	Very low	44.4	Very low	107 Å²	107	118.4 Å²	118.4	70%	0.695	66%	0.655	S	S	*	*			trans	-51.5	127.3	171.4	21.4	-30.6	0	0	0	108.1	H306	P304-H306 PolarHBondContact O-N 3.39Å
305	A	40.1	Very low	43.8	Very low	44 Å²	44	124.1 Å²	124.1	36%	0.364	67%	0.671	S	S	.	*			trans	-53.8	110.7	171.4	0	0	0	0	0	106.6	P303 L307	P303-A305 PolarHBondContact O-N 2.98Å; P303-A305 VanDerWaalsContact O-N 3.12Å; A305-L307 PolarHBondContact O-N 3.22Å
306	H	40	Very low	43.2	Very low	168 Å²	168	125.1 Å²	125.1	78%	0.778	69%	0.692	S	S	*	*			trans	-56.1	129.7	-174.4	-76.8	-80.2	0	0	0	109.5	P304	P304-H306 PolarHBondContact O-N 3.39Å
307	L	36.5	Very low	42.9	Very low	235 Å²	235	127.4 Å²	127.4	100%	1.23	69%	0.691	S	S	*	*			trans	-52.5	0	168.8	-73.7	162.9	0	0	0	111.7	A305	A305-L307 PolarHBondContact O-N 3.22Å

Retrieved 307 of 307 residues in 503 ms (Link to these results)

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