A0A077ZKR3_TRITR Loading...

DUF1758 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKR3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 469 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	29.9	Very low	30.3	Very low	231 Å²	231	153 Å²	153	100%	1.138	83%	0.829	S	S	*	*				0	129.7	0	-84.9	-175.7	-89.7	0	0	107.5
2	H	26.6	Very low	30.2	Very low	159 Å²	159	156.9 Å²	156.9	74%	0.736	84%	0.838	S	S	*	*			trans	23.2	134.4	149.9	-66.8	-91.8	0	0	0	117.5
3	E	26.7	Very low	30.3	Very low	151 Å²	151	158.2 Å²	158.2	71%	0.706	83%	0.826	S	S	*	*			cis	-177.3	133.1	26.1	-127.7	154.2	-156.6	0	0	105
4	C	25	Very low	30.8	Very low	144 Å²	144	156.2 Å²	156.2	97%	0.973	81%	0.81	S	S	*	*			trans	-123.4	89.7	164.4	-128.2	0	0	0	0	106.3
5	S	29.2	Very low	31.4	Very low	87 Å²	87	153.6 Å²	153.6	61%	0.608	81%	0.807	S	S	*	*			trans	-131	88.1	175.6	59.3	0	0	0	0	109.2
6	E	33.7	Very low	31.7	Very low	205 Å²	205	154.5 Å²	154.5	96%	0.958	81%	0.808	S	S	*	*			trans	-101.8	112.8	152.7	-86.1	-170.8	156.4	0	0	108.5
7	K	31.5	Very low	31.8	Very low	191 Å²	191	153.6 Å²	153.6	83%	0.83	80%	0.804	S	S	*	*			trans	-71	141	177.3	-64.8	169.8	172.3	178.1	0	110.2
8	V	32.9	Very low	31.9	Very low	149 Å²	149	151.2 Å²	151.2	90%	0.903	80%	0.796	S	S	*	*			trans	-145.5	137.1	131.1	-174.3	0	0	0	0	108.7
9	E	35	Very low	32	Very low	185 Å²	185	146.6 Å²	146.6	86%	0.864	79%	0.788	S	S	*	*			trans	-74.6	149.1	-165	-62.3	163.2	142.5	0	0	115
10	G	30.6	Very low	32.1	Very low	72 Å²	72	149.4 Å²	149.4	74%	0.742	79%	0.793	S	S	*	*	S	Bend	trans	100.5	93.9	141.3	0	0	0	0	0	118.8
11	V	32.3	Very low	32	Very low	109 Å²	109	153.9 Å²	153.9	66%	0.661	80%	0.799	S	S	*	*			trans	87.8	98.3	161.3	-161	0	0	0	0	117.3	Y13	V11-Y13 HydrophobicContact CB-CE2 4.07Å; V11-Y13 HydrophobicContact CG1-CD2 4.14Å; V11-Y13 HydrophobicContact CG1-CE1 4.32Å; V11-Y13 HydrophobicContact CG1-CE2 3.58Å
12	Q	29.2	Very low	32.1	Very low	200 Å²	200	153.4 Å²	153.4	94%	0.935	79%	0.785	S	S	*	*			trans	-70.3	123.2	164.1	-84.3	-179.8	-29.2	0	0	110.8
13	Y	31.2	Very low	32.1	Very low	173 Å²	173	157.5 Å²	157.5	68%	0.678	79%	0.794	S	S	*	*			trans	-104.7	143.4	167.8	-70.4	-84.7	0	0	0	110.9	V11	V11-Y13 HydrophobicContact CB-CE2 4.07Å; V11-Y13 HydrophobicContact CG1-CD2 4.14Å; V11-Y13 HydrophobicContact CG1-CE1 4.32Å; V11-Y13 HydrophobicContact CG1-CE2 3.58Å
14	H	37.9	Very low	32.3	Very low	131 Å²	131	158.3 Å²	158.3	61%	0.606	80%	0.797	S	S	*	*			trans	-60.3	133.3	-179.9	-168.8	-88.9	0	0	0	111.1	M16 L17	H14-M16 PolarHBondContact O-N 3.34Å; H14-L17 PolarHBondContact O-N 3.21Å; H14-L17 VanDerWaalsContact O-N 3.12Å
15	P	39.2	Very low	32.3	Very low	117 Å²	117	161.9 Å²	161.9	76%	0.76	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-56.6	-17.5	-167.7	-27.6	33.4	0	0	0	117.3	L17	P15-L17 VanDerWaalsContact C-N 3.31Å; P15-L17 PolarHBondContact O-N 3.44Å
16	M	36.9	Very low	32.3	Very low	168 Å²	168	161.1 Å²	161.1	83%	0.828	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-77.1	-8.2	178	-87.4	-147.3	-65.1	0	0	115.2	H14	H14-M16 PolarHBondContact O-N 3.34Å
17	L	32.6	Very low	32	Very low	140 Å²	140	160.7 Å²	160.7	73%	0.733	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-107.9	0.1	-172.2	-67.2	171.5	0	0	0	115	H14 P15 G19	H14-L17 PolarHBondContact O-N 3.21Å; H14-L17 VanDerWaalsContact O-N 3.12Å; P15-L17 VanDerWaalsContact C-N 3.31Å; P15-L17 PolarHBondContact O-N 3.44Å; L17-G19 PolarHBondContact O-N 2.99Å
18	V	33.2	Very low	31.8	Very low	110 Å²	110	156.9 Å²	156.9	67%	0.667	80%	0.804	S	S	*	*			trans	-84.7	62.1	179.6	-165.6	0	0	0	0	110.8	K20	V18-K20 PolarHBondContact O-N 2.8Å
19	G	33.6	Very low	31.7	Very low	63 Å²	63	154.9 Å²	154.9	65%	0.649	80%	0.797	S	S	*	*			trans	-73.3	102.3	162.9	0	0	0	0	0	109.2	L17 R21	L17-G19 PolarHBondContact O-N 2.99Å; G19-R21 PolarHBondContact O-N 3.39Å
20	K	33.9	Very low	31.6	Very low	203 Å²	203	154.7 Å²	154.7	88%	0.883	80%	0.796	S	S	*	*			trans	-53.4	93.3	173.4	-80.1	-179.6	174	176.1	0	110.9	V18 R22	V18-K20 PolarHBondContact O-N 2.8Å; K20-R22 PolarHBondContact O-N 3.1Å; K20-R22 VanDerWaalsContact O-N 3.16Å
21	R	31	Very low	31.6	Very low	244 Å²	244	158.5 Å²	158.5	92%	0.921	80%	0.799	S	S	*	*			trans	-76.6	94.4	163.2	-88.5	-173.2	172.8	-170.5	-0.7	108.7	G19 R23	G19-R21 PolarHBondContact O-N 3.39Å; R21-R23 PolarHBondContact O-N 3.04Å
22	R	32	Very low	31.3	Very low	221 Å²	221	164.7 Å²	164.7	83%	0.834	81%	0.811	S	S	*	*			trans	-71.2	115.3	168.5	-146.8	176	179.3	-178.8	-2.8	107.8	K20 E24	K20-R22 PolarHBondContact O-N 3.1Å; K20-R22 VanDerWaalsContact O-N 3.16Å; R22-E24 PolarHBondContact O-N 3.46Å
23	R	27.5	Very low	31.3	Very low	245 Å²	245	164.2 Å²	164.2	93%	0.925	81%	0.806	S	S	*	*			trans	-74.1	106	171.8	-80.9	178.7	166.5	176.2	-3.9	108.5	R21	R21-R23 PolarHBondContact O-N 3.04Å
24	E	29.4	Very low	31.2	Very low	167 Å²	167	162 Å²	162	78%	0.78	81%	0.81	S	S	*	*			trans	-100.1	119.7	161.5	-78.3	179.3	178.2	0	0	108.6	R22	R22-E24 PolarHBondContact O-N 3.46Å
25	K	26.4	Very low	30.6	Very low	219 Å²	219	164.5 Å²	164.5	95%	0.952	82%	0.822	S	S	*	*			trans	-75.7	118.6	168.2	-75.5	-179.6	174.9	-178.8	0	107.3
26	G	27.8	Very low	30.2	Very low	72 Å²	72	165 Å²	165	74%	0.742	82%	0.823	S	S	*	*			trans	-168.1	116.4	175.6	0	0	0	0	0	111.1
27	Q	27	Very low	29.6	Very low	196 Å²	196	159.8 Å²	159.8	92%	0.916	81%	0.812	S	S	*	*			trans	-22	144	-176.8	-76.9	157.9	-30.6	0	0	120.2	S29	Q27-S29 PolarHBondContact O-N 2.93Å
28	A	28.8	Very low	29.2	Very low	110 Å²	110	161.5 Å²	161.5	91%	0.909	82%	0.821	S	S	*	*			trans	-51.7	122.9	174.8	0	0	0	0	0	112.9
29	S	31.3	Very low	28.8	Very low	108 Å²	108	162.1 Å²	162.1	76%	0.755	82%	0.824	S	S	*	*			trans	-132.4	110.5	159	168.6	0	0	0	0	106.4	Q27	Q27-S29 PolarHBondContact O-N 2.93Å
30	E	31	Very low	28.5	Very low	180 Å²	180	162.2 Å²	162.2	84%	0.841	83%	0.826	S	S	*	*			trans	-56.9	145.9	177.2	-92.6	171.2	141	0	0	112.4
31	N	31	Very low	28.3	Very low	152 Å²	152	159.4 Å²	159.4	81%	0.813	82%	0.817	S	S	*	*			trans	66.8	60.3	163.4	-70.7	-21.8	0	0	0	118.2	K33	N31-K33 VanDerWaalsContact C-N 3.25Å; N31-K33 PolarHBondContact O-N 2.91Å
32	R	27	Very low	28.6	Very low	239 Å²	239	154 Å²	154	90%	0.902	81%	0.806	S	S	*	*			trans	-72.3	80.5	150.2	-72.1	-175.3	-179.6	174.6	1	110.5	V34	R32-V34 PolarHBondContact O-N 2.89Å
33	K	28.3	Very low	29.4	Very low	191 Å²	191	147.8 Å²	147.8	83%	0.83	79%	0.793	S	S	*	*			trans	-65.1	118.8	146.9	-84.6	-177.2	177.5	177.3	0	105.8	N31 Q35	N31-K33 VanDerWaalsContact C-N 3.25Å; N31-K33 PolarHBondContact O-N 2.91Å; K33-Q35 PolarHBondContact O-N 2.86Å
34	V	29.2	Very low	30.7	Very low	127 Å²	127	142.5 Å²	142.5	77%	0.77	78%	0.777	S	S	*	*			trans	-61.4	90.2	170.4	179.5	0	0	0	0	106.6	R32 V36	R32-V34 PolarHBondContact O-N 2.89Å; V34-V36 VanDerWaalsContact C-N 3.29Å; V34-V36 HydrophobicContact CG1-CG2 4.05Å; V34-V36 PolarHBondContact O-N 3.23Å
35	Q	24.7	Very low	32.3	Very low	182 Å²	182	134.9 Å²	134.9	85%	0.85	74%	0.743	S	S	*	*			trans	-69	98.6	162.5	-80.5	-175.5	-20.8	0	0	105.2	K33 G37	K33-Q35 PolarHBondContact O-N 2.86Å; Q35-G37 PolarHBondContact O-N 3.13Å
36	V	31.1	Very low	34.5	Very low	128 Å²	128	127.9 Å²	127.9	78%	0.776	71%	0.711	S	S	*	*			trans	-64.2	90	164.8	-174.4	0	0	0	0	105.2	V34 L38	V34-V36 VanDerWaalsContact C-N 3.29Å; V34-V36 HydrophobicContact CG1-CG2 4.05Å; V34-V36 PolarHBondContact O-N 3.23Å; V36-L38 PolarHBondContact O-N 2.64Å; V36-L38 VanDerWaalsContact O-N 3.11Å
37	G	23.8	Very low	36.9	Very low	58 Å²	58	128.7 Å²	128.7	60%	0.598	70%	0.701	S	S	*	*			trans	-56.3	117.7	176.6	0	0	0	0	0	108.5	Q35 V39	Q35-G37 PolarHBondContact O-N 3.13Å; G37-V39 PolarHBondContact O-N 2.71Å
38	L	24.3	Very low	39.6	Very low	176 Å²	176	119.8 Å²	119.8	92%	0.921	66%	0.66	S	S	*	*			trans	-63.7	83.3	161.9	-98.2	126	0	0	0	107.1	V36 G40	V36-L38 PolarHBondContact O-N 2.64Å; V36-L38 VanDerWaalsContact O-N 3.11Å; L38-G40 PolarHBondContact O-N 2.88Å; L38-G40 VanDerWaalsContact O-N 3.11Å
39	V	26.7	Very low	42.4	Very low	123 Å²	123	117.4 Å²	117.4	75%	0.745	63%	0.631	S	S	*	*			trans	-64.7	109.7	154.1	175.9	0	0	0	0	103.9	G37 M41	G37-V39 PolarHBondContact O-N 2.71Å; V39-M41 VanDerWaalsContact C-N 3.25Å; V39-M41 PolarHBondContact O-N 2.81Å
40	G	26.2	Very low	45.3	Very low	66 Å²	66	114.2 Å²	114.2	68%	0.68	61%	0.605	S	S	*	*			trans	-53.8	96.1	171.5	0	0	0	0	0	107.9	L38 L42	L38-G40 PolarHBondContact O-N 2.88Å; L38-G40 VanDerWaalsContact O-N 3.11Å; G40-L42 PolarHBondContact O-N 3.02Å
41	M	30.3	Very low	48.2	Very low	143 Å²	143	106 Å²	106	70%	0.704	57%	0.567	S	S	*	*			trans	-65.8	121.7	175.5	-85.5	-155.1	-83.6	0	0	106.2	V39 T43	V39-M41 VanDerWaalsContact C-N 3.25Å; V39-M41 PolarHBondContact O-N 2.81Å; M41-T43 PolarHBondContact O-N 2.84Å
42	L	37	Very low	51	Low	131 Å²	131	99.1 Å²	99.1	69%	0.686	53%	0.531	S	S	*	.			trans	-45.3	115.1	161.3	-69.7	159.7	0	0	0	106.6	G40 K44	G40-L42 PolarHBondContact O-N 3.02Å; L42-K44 PolarHBondContact O-N 3.07Å
43	T	48.5	Very low	54.1	Low	90 Å²	90	94.4 Å²	94.4	55%	0.552	51%	0.513	S	S	*	.			trans	-57.5	115.3	-172.2	47	0	0	0	0	108.4	M41	M41-T43 PolarHBondContact O-N 2.84Å
44	K	54.2	Low	57.2	Low	134 Å²	134	85.3 Å²	85.3	58%	0.583	47%	0.473	S	S	*	.			trans	-58.5	141.6	-178.2	-67.2	-179.7	179.1	-179.9	0	109.7	L42	L42-K44 PolarHBondContact O-N 3.07Å
45	G	63	Low	60.3	Low	8 Å²	8	79.9 Å²	79.9	8%	0.082	44%	0.44	C	S	.	.			trans	-70.1	-143.6	175.1	0	0	0	0	0	112.4	V47 G207	G45-V47 PolarHBondContact O-N 3.12Å; G45-G207 PolarHBondContact N-O 3.27Å
46	R	73.2	Confident	63.7	Low	72 Å²	72	71.2 Å²	71.2	27%	0.272	40%	0.4	S	S	.	.			trans	-62.7	136.3	179	-166.8	172.1	179.3	-167.9	-6.8	111.4	A149 M206 L212	R46-A149 PolarHBondContact NH1-O 3.23Å; R46-A149 PolarHBondContact NH2-O 3.47Å; R46-M206 HydrophobicContact CB-CG 4.48Å; R46-M206 WeakPolarHBondContact O-CB 3.4Å; R46-M206 WeakPolarHBondContact O-CG 3.17Å; R46-M206 PolarHBondContact O-N 2.84Å; R46-L212 HydrophobicContact CB-CD1 3.73Å; R46-L212 HydrophobicContact CG-CD1 3.96Å
47	V	79	Confident	66.8	Low	89 Å²	89	68.6 Å²	68.6	54%	0.539	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.6	174.2	-178.4	0	0	0	0	109.3	G45 G204	G45-V47 PolarHBondContact O-N 3.12Å; V47-G204 WeakPolarHBondContact CA-O 3.41Å
48	L	82.9	Confident	70.2	Confident	8 Å²	8	66.1 Å²	66.1	4%	0.042	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.1	176.5	-61.8	179.5	0	0	0	110.4	Y161 V202 G204 M206	L48-Y161 HydrophobicContact CD1-CE1 3.77Å; L48-V202 HydrophobicContact CD1-CG1 4.09Å; L48-G204 PolarHBondContact N-O 2.66Å; L48-G204 PolarHBondContact O-N 2.92Å; L48-M206 HydrophobicContact CD1-CG 4.15Å; L48-M206 HydrophobicContact CD1-SD 3.38Å; L48-M206 WeakPolarHBondContact CD1-SD 3.29Å; L48-M206 HydrophobicContact CD2-CG 4.5Å; L48-M206 HydrophobicContact CG-CG 3.96Å; L48-M206 HydrophobicContact CG-SD 3.89Å
49	L	88.1	Confident	73.2	Confident	60 Å²	60	63.2 Å²	63.2	31%	0.314	33%	0.332	S	S	.	.			trans	-79.7	155.6	172.1	-62	179.6	0	0	0	110.8	T51 L69 I147 L218	L49-T51 HydrophobicContact CB-CG2 4.11Å; L49-T51 PolarHBondContact O-N 3.19Å; L49-T51 VanDerWaalsContact O-N 3.1Å; L49-L69 HydrophobicContact CB-CD1 3.86Å; L49-L69 HydrophobicContact CD1-CD1 4.2Å; L49-I147 HydrophobicContact CD1-CG2 4.4Å; L49-L218 HydrophobicContact CD1-CD1 4.03Å
50	Q	91.1	Very high	76.2	Confident	42 Å²	42	61.8 Å²	61.8	20%	0.196	33%	0.328	C	S	.	.			trans	-78	92.6	176.8	-64.1	-177.8	28.7	0	0	110.5	L70 Y177 L194 I201 C203	Q50-L70 HydrophobicContact CB-CB 3.96Å; Q50-L70 PolarHBondContact O-N 3.16Å; Q50-Y177 VanDerWaalsContact CD-OH 3.3Å; Q50-Y177 PolarHBondContact NE2-OH 2.93Å; Q50-Y177 PolarHBondContact OE1-OH 3.24Å; Q50-L194 HydrophobicContact CG-CD2 4.36Å; Q50-I201 HydrophobicContact CB-CD1 3.88Å; Q50-I201 HydrophobicContact CG-CD1 4.48Å; Q50-C203 HydrophobicContact CB-CB 4.35Å; Q50-C203 HydrophobicContact CG-CB 3.52Å
51	T	91.8	Very high	79.3	Confident	8 Å²	8	60.4 Å²	60.4	5%	0.049	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.4	-177.1	64	0	0	0	0	110.9	L49 C68 L69 I147 R163 I168	L49-T51 HydrophobicContact CB-CG2 4.11Å; L49-T51 PolarHBondContact O-N 3.19Å; L49-T51 VanDerWaalsContact O-N 3.1Å; T51-C68 CarbonylContact C-O 3.56Å; T51-C68 WeakPolarHBondContact CA-O 3.08Å; T51-L69 HydrophobicContact CG2-CD1 3.94Å; T51-I147 HydrophobicContact CG2-CD1 3.65Å; T51-R163 PolarHBondContact OG1-NH1 3.4Å; T51-I168 HydrophobicContact CG2-CD1 4.19Å
52	A	91	Very high	82.3	Confident	6 Å²	6	57.6 Å²	57.6	5%	0.05	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147	-179.1	0	0	0	0	0	110.8	C68 L70 F198 I201	A52-C68 PolarHBondContact N-O 3.09Å; A52-C68 PolarHBondContact O-N 2.72Å; A52-L70 HydrophobicContact CB-CD1 4.45Å; A52-F198 HydrophobicContact CB-CB 4.01Å; A52-F198 HydrophobicContact CB-CD2 3.51Å; A52-F198 HydrophobicContact CB-CE2 4.39Å; A52-F198 HydrophobicContact CB-CG 4.12Å; A52-I201 HydrophobicContact CB-CG2 3.88Å
53	R	91.7	Very high	85	Confident	140 Å²	140	57.4 Å²	57.4	53%	0.528	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137	164.6	-68.9	-178	74.4	171.8	4	109.1	V66 M67 L121	R53-V66 WeakPolarHBondContact CA-O 3.42Å; R53-M67 HydrophobicContact CG-CE 3.48Å; R53-M67 VanDerWaalsContact CG-CE 3.48Å; R53-M67 HydrophobicContact CG-SD 4.04Å; R53-L121 HydrophobicContact CB-CD1 3.8Å; R53-L121 HydrophobicContact CB-CD2 4.41Å; R53-L121 HydrophobicContact CB-CG 4.31Å
54	A	94.1	Very high	87.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	162.4	178	0	0	0	0	0	110.5	V65 V66 L118 S119 F198	A54-V65 WeakPolarHBondContact O-CA 3.4Å; A54-V66 HydrophobicContact CB-CG2 4.11Å; A54-V66 PolarHBondContact N-O 3.38Å; A54-V66 PolarHBondContact O-N 3.16Å; A54-L118 HydrophobicContact CB-CD2 4.34Å; A54-S119 WeakPolarHBondContact CA-O 3.33Å; A54-F198 HydrophobicContact CB-CD1 3.62Å; A54-F198 HydrophobicContact CB-CD2 4.48Å; A54-F198 HydrophobicContact CB-CE1 3.47Å; A54-F198 VanDerWaalsContact CB-CE1 3.47Å; A54-F198 HydrophobicContact CB-CE2 4.34Å; A54-F198 HydrophobicContact CB-CG 4.13Å; A54-F198 HydrophobicContact CB-CZ 3.84Å
55	V	94.5	Very high	89.2	Confident	13 Å²	13	51.3 Å²	51.3	8%	0.079	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.5	163.5	-177.2	0	0	0	0	107.8	R63 L118 S119 L121 W132	V55-R63 HydrophobicContact CG1-CB 4.18Å; V55-L118 CarbonylContact O-C 3.46Å; V55-L118 WeakPolarHBondContact O-CA 3.18Å; V55-S119 PolarHBondContact N-O 3.07Å; V55-S119 PolarHBondContact O-N 3Å; V55-L121 HydrophobicContact CG2-CD2 3.87Å; V55-W132 HydrophobicContact CB-CH2 4.46Å; V55-W132 HydrophobicContact CG1-CH2 3.94Å; V55-W132 HydrophobicContact CG1-CZ3 4.45Å
56	M	96.5	Very high	90.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	141.2	167.9	-170.8	-179.6	84.5	0	0	109.8	R63 T64 V66 I79 L83 M87 F116 A117 L118	M56-R63 VanDerWaalsContact O-CA 3.24Å; M56-R63 WeakPolarHBondContact O-CA 3.17Å; M56-T64 HydrophobicContact CB-CG2 4.28Å; M56-T64 HydrophobicContact CE-CG2 4.03Å; M56-T64 PolarHBondContact N-O 3.23Å; M56-T64 PolarHBondContact O-N 2.83Å; M56-V66 HydrophobicContact CB-CG1 3.8Å; M56-V66 HydrophobicContact CB-CG2 4.08Å; M56-V66 HydrophobicContact SD-CG1 4.37Å; M56-I79 HydrophobicContact SD-CD1 4.01Å; M56-L83 HydrophobicContact CE-CD1 4.12Å; M56-L83 HydrophobicContact CE-CD2 4.15Å; M56-L83 HydrophobicContact CE-CG 4.13Å; M56-L83 HydrophobicContact SD-CD2 3.93Å; M56-M87 HydrophobicContact CE-CB 3.61Å; M56-M87 HydrophobicContact CE-CE 4Å; M56-M87 HydrophobicContact CE-CG 3.48Å; M56-M87 VanDerWaalsContact CE-CG 3.48Å; M56-F116 HydrophobicContact CG-CB 3.98Å; M56-F116 HydrophobicContact CG-CD2 3.61Å; M56-F116 HydrophobicContact CG-CE2 4.37Å; M56-F116 HydrophobicContact CG-CG 3.97Å; M56-F116 HydrophobicContact SD-CB 4.13Å; M56-F116 HydrophobicContact SD-CD1 4.29Å; M56-F116 HydrophobicContact SD-CD2 3.71Å; M56-F116 HydrophobicContact SD-CE2 4.16Å; M56-F116 HydrophobicContact SD-CG 3.78Å; M56-A117 CarbonylContact C-O 3.59Å; M56-A117 WeakPolarHBondContact CA-O 3.38Å; M56-L118 HydrophobicContact CB-CD2 3.86Å; M56-L118 HydrophobicContact CG-CD2 4.04Å
57	R	94.8	Very high	91.8	Very high	74 Å²	74	48.4 Å²	48.4	28%	0.279	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.8	171.5	-172.8	-178.9	67.1	-168.7	-1.9	110.6	D62 R63 A117 W132	R57-D62 CarbonylContact C-O 3.34Å; R57-D62 WeakPolarHBondContact CA-O 3.25Å; R57-R63 HydrophobicContact CB-CG 4.18Å; R57-R63 HydrophobicContact CG-CG 3.97Å; R57-A117 PolarHBondContact N-O 2.99Å; R57-A117 PolarHBondContact O-N 3.03Å; R57-W132 HydrophobicContact CB-CE3 4.1Å; R57-W132 HydrophobicContact CB-CH2 3.55Å; R57-W132 HydrophobicContact CB-CZ2 4.43Å; R57-W132 HydrophobicContact CB-CZ3 3.35Å; R57-W132 HydrophobicContact CG-CH2 4.36Å; R57-W132 HydrophobicContact CG-CZ3 4.49Å
58	T	95	Very high	92.6	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.031	23%	0.228	C	C	.	.			trans	-76	171.2	172.3	64	0	0	0	0	111	S60 G61 D62 M87 L89	T58-S60 VanDerWaalsContact C-N 3.26Å; T58-S60 PolarHBondContact O-N 3Å; T58-S60 PolarHBondContact OG1-N 3.45Å; T58-S60 PolarHBondContact OG1-OG 2.86Å; T58-G61 PolarHBondContact O-N 3.44Å; T58-G61 VanDerWaalsContact O-N 3.14Å; T58-G61 PolarHBondContact OG1-N 3.11Å; T58-D62 HydrophobicContact CG2-CB 4.13Å; T58-D62 PolarHBondContact N-O 3.22Å; T58-D62 WeakPolarHBondContact OG1-CB 3.43Å; T58-D62 PolarHBondContact OG1-N 3.27Å; T58-D62 PolarHBondContact OG1-O 3.22Å; T58-M87 HydrophobicContact CG2-CB 3.98Å; T58-M87 HydrophobicContact CG2-CE 3.6Å; T58-L89 HydrophobicContact CG2-CD2 3.75Å
59	M	88.4	Confident	93.2	Very high	115 Å²	115	43.9 Å²	43.9	57%	0.567	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-25.2	172.6	-59.8	-55	155	0	0	112.9	G61 Q115 T134	M59-G61 PolarHBondContact O-N 3.37Å; M59-Q115 HydrophobicContact CE-CB 3.93Å; M59-Q115 HydrophobicContact CE-CG 3.56Å; M59-Q115 VanDerWaalsContact CE-OE1 3.31Å; M59-T134 HydrophobicContact CE-CG2 4.08Å
60	S	89.6	Confident	93.5	Very high	93 Å²	93	41.3 Å²	41.3	65%	0.65	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.7	170.8	52.1	0	0	0	0	113.2	T58 D62	T58-S60 VanDerWaalsContact C-N 3.26Å; T58-S60 PolarHBondContact O-N 3Å; T58-S60 PolarHBondContact OG1-N 3.45Å; T58-S60 PolarHBondContact OG1-OG 2.86Å; S60-D62 PolarHBondContact OG-OD2 3.36Å
61	G	90	Very high	93.5	Very high	37 Å²	37	40.2 Å²	40.2	38%	0.381	21%	0.208	S	C	.	.			trans	101.4	-6	178.9	0	0	0	0	0	115	T58 M59 R63	T58-G61 PolarHBondContact O-N 3.44Å; T58-G61 VanDerWaalsContact O-N 3.14Å; T58-G61 PolarHBondContact OG1-N 3.11Å; M59-G61 PolarHBondContact O-N 3.37Å; G61-R63 WeakPolarHBondContact O-CG 3.32Å
62	D	93.6	Very high	93.3	Very high	84 Å²	84	42.1 Å²	42.1	45%	0.449	22%	0.224	S	C	.	.			trans	-60.7	140.2	176.4	-58.7	-56.8	0	0	0	111	R57 T58 S60 M87	R57-D62 CarbonylContact C-O 3.34Å; R57-D62 WeakPolarHBondContact CA-O 3.25Å; T58-D62 HydrophobicContact CG2-CB 4.13Å; T58-D62 PolarHBondContact N-O 3.22Å; T58-D62 WeakPolarHBondContact OG1-CB 3.43Å; T58-D62 PolarHBondContact OG1-N 3.27Å; T58-D62 PolarHBondContact OG1-O 3.22Å; S60-D62 PolarHBondContact OG-OD2 3.36Å; D62-M87 HydrophobicContact CB-CE 3.9Å
63	R	94.3	Very high	93	Very high	128 Å²	128	43.1 Å²	43.1	48%	0.483	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.3	-174.8	-59.6	-177.9	-171.8	-179.1	2.2	111.8	V55 M56 R57 G61 E125	V55-R63 HydrophobicContact CG1-CB 4.18Å; M56-R63 VanDerWaalsContact O-CA 3.24Å; M56-R63 WeakPolarHBondContact O-CA 3.17Å; R57-R63 HydrophobicContact CB-CG 4.18Å; R57-R63 HydrophobicContact CG-CG 3.97Å; G61-R63 WeakPolarHBondContact O-CG 3.32Å; R63-E125 IonicContact NH1-OE1 3.45Å
64	T	96	Very high	92.9	Very high	35 Å²	35	36.4 Å²	36.4	22%	0.215	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	154.3	169.8	-174	0	0	0	0	110.3	M56 V66 L83 M87	M56-T64 HydrophobicContact CB-CG2 4.28Å; M56-T64 HydrophobicContact CE-CG2 4.03Å; M56-T64 PolarHBondContact N-O 3.23Å; M56-T64 PolarHBondContact O-N 2.83Å; T64-V66 HydrophobicContact CG2-CG1 3.85Å; T64-L83 HydrophobicContact CG2-CD1 3.97Å; T64-M87 HydrophobicContact CG2-CE 3.69Å; T64-M87 HydrophobicContact CG2-CG 3.85Å; T64-M87 HydrophobicContact CG2-SD 3.58Å; T64-M87 VanDerWaalsContact CG2-SD 3.58Å
65	V	94.8	Very high	92.5	Very high	61 Å²	61	40.1 Å²	40.1	37%	0.37	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	137.9	168.7	178.3	0	0	0	0	108.9	A54 L121	A54-V65 WeakPolarHBondContact O-CA 3.4Å; V65-L121 HydrophobicContact CB-CD2 4.44Å; V65-L121 HydrophobicContact CG1-CD2 3.77Å; V65-L121 HydrophobicContact CG2-CD2 3.87Å
66	V	95.7	Very high	92.4	Very high	3 Å²	3	44 Å²	44	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	154.7	-179	-60.9	0	0	0	0	110.8	R53 A54 M56 T64 L83 L118 D169	R53-V66 WeakPolarHBondContact CA-O 3.42Å; A54-V66 HydrophobicContact CB-CG2 4.11Å; A54-V66 PolarHBondContact N-O 3.38Å; A54-V66 PolarHBondContact O-N 3.16Å; M56-V66 HydrophobicContact CB-CG1 3.8Å; M56-V66 HydrophobicContact CB-CG2 4.08Å; M56-V66 HydrophobicContact SD-CG1 4.37Å; T64-V66 HydrophobicContact CG2-CG1 3.85Å; V66-L83 HydrophobicContact CB-CD2 4.45Å; V66-L83 HydrophobicContact CG1-CD1 4.13Å; V66-L83 HydrophobicContact CG1-CD2 3.6Å; V66-L118 HydrophobicContact CG2-CD2 4.02Å; V66-D169 WeakPolarHBondContact CA-OD2 3.39Å; V66-D169 HydrophobicContact CB-CB 4.16Å; V66-D169 HydrophobicContact CG1-CB 4.47Å
67	M	94.6	Very high	92.4	Very high	16 Å²	16	44.1 Å²	44.1	8%	0.079	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.7	168.4	-171.7	64.3	65.4	0	0	110	R53 R163 K167 I168 D169 V170	R53-M67 HydrophobicContact CG-CE 3.48Å; R53-M67 VanDerWaalsContact CG-CE 3.48Å; R53-M67 HydrophobicContact CG-SD 4.04Å; M67-R163 HydrophobicContact CE-CG 4.02Å; M67-K167 VanDerWaalsContact CB-O 3.31Å; M67-K167 WeakPolarHBondContact CB-O 3.36Å; M67-I168 HydrophobicContact CG-CD1 3.69Å; M67-D169 PolarHBondContact N-OD2 2.92Å; M67-D169 PolarHBondContact O-N 3.38Å; M67-V170 PolarHBondContact O-N 3.44Å
68	C	95.8	Very high	92.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	146.1	178.5	-60.9	0	0	0	0	111.3	T51 A52 V170 I172	T51-C68 CarbonylContact C-O 3.56Å; T51-C68 WeakPolarHBondContact CA-O 3.08Å; A52-C68 PolarHBondContact N-O 3.09Å; A52-C68 PolarHBondContact O-N 2.72Å; C68-V170 CarbonylContact C-O 3.53Å; C68-V170 VanDerWaalsContact CA-O 3.26Å; C68-V170 WeakPolarHBondContact CA-O 3.4Å; C68-I172 HydrophobicContact CB-CD1 4.14Å
69	L	94.9	Very high	92.5	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.9	165.9	172.2	65.4	0	0	0	108.8	L49 T51 D71 I168 V170 L171 I172 L218	L49-L69 HydrophobicContact CB-CD1 3.86Å; L49-L69 HydrophobicContact CD1-CD1 4.2Å; T51-L69 HydrophobicContact CG2-CD1 3.94Å; L69-D71 HydrophobicContact CG-CB 4.41Å; L69-I168 HydrophobicContact CB-CD1 4.02Å; L69-I168 HydrophobicContact CB-CG1 4.19Å; L69-I168 HydrophobicContact CB-CG2 3.73Å; L69-V170 PolarHBondContact N-O 2.67Å; L69-L171 HydrophobicContact CD2-CD1 4.12Å; L69-L171 CarbonylContact O-C 3.55Å; L69-L171 WeakPolarHBondContact O-CA 3.32Å; L69-I172 PolarHBondContact O-N 2.85Å; L69-L218 HydrophobicContact CD2-CD1 3.56Å
70	L	94.8	Very high	92.8	Very high	5 Å²	5	35 Å²	35	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.3	171.4	-70	77.9	0	0	0	108	Q50 A52 I172 Y177 F180 T196	Q50-L70 HydrophobicContact CB-CB 3.96Å; Q50-L70 PolarHBondContact O-N 3.16Å; A52-L70 HydrophobicContact CB-CD1 4.45Å; L70-I172 HydrophobicContact CG-CB 4.5Å; L70-I172 HydrophobicContact CG-CD1 4.45Å; L70-Y177 HydrophobicContact CB-CD2 4Å; L70-Y177 HydrophobicContact CB-CE2 3.81Å; L70-F180 HydrophobicContact CD2-CB 4.2Å; L70-T196 HydrophobicContact CD2-CG2 4.19Å
71	D	91.8	Very high	93	Very high	20 Å²	20	33 Å²	33	11%	0.107	18%	0.181	C	C	.	.			trans	-128.3	99.2	-174.1	-173.9	11.3	0	0	0	111.4	L69 G73 S74 L171 I172 L218	L69-D71 HydrophobicContact CG-CB 4.41Å; D71-G73 PolarHBondContact O-N 3.45Å; D71-G73 WeakPolarHBondContact OD1-CA 2.93Å; D71-G73 PolarHBondContact OD1-N 2.79Å; D71-S74 PolarHBondContact O-N 2.94Å; D71-S74 VanDerWaalsContact O-N 3.14Å; D71-L171 HydrophobicContact CB-CD1 4.03Å; D71-L171 HydrophobicContact CB-CD2 4.08Å; D71-L171 HydrophobicContact CB-CG 4.01Å; D71-I172 PolarHBondContact N-O 2.63Å; D71-L218 WeakPolarHBondContact OD2-CB 3.35Å
72	A	87.9	Confident	93.2	Very high	47 Å²	47	36.2 Å²	36.2	39%	0.388	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-7.8	173	0	0	0	0	0	113.2	L174 Y177	A72-L174 HydrophobicContact CB-CD2 3.8Å; A72-L174 HydrophobicContact CB-CG 4.42Å; A72-L174 WeakPolarHBondContact O-CD1 3.47Å; A72-L174 VanDerWaalsContact O-CG 3.28Å; A72-L174 WeakPolarHBondContact O-CG 3.38Å; A72-Y177 HydrophobicContact CB-CD2 4.19Å; A72-Y177 HydrophobicContact CB-CE2 3.97Å
73	G	85.1	Confident	93.3	Very high	27 Å²	27	32.2 Å²	32.2	28%	0.278	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.9	172.4	0	0	0	0	0	114	D71 H219 A220	D71-G73 PolarHBondContact O-N 3.45Å; D71-G73 WeakPolarHBondContact OD1-CA 2.93Å; D71-G73 PolarHBondContact OD1-N 2.79Å; G73-H219 WeakPolarHBondContact O-CA 3.48Å; G73-H219 PolarHBondContact O-ND1 2.8Å; G73-A220 PolarHBondContact O-N 2.91Å
74	S	88.1	Confident	93.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-101.3	133	175.2	-174.6	0	0	0	0	111	D71 R76 F78 L171 G173 L174	D71-S74 PolarHBondContact O-N 2.94Å; D71-S74 VanDerWaalsContact O-N 3.14Å; S74-R76 VanDerWaalsContact C-N 3.34Å; S74-R76 PolarHBondContact OG-N 3.18Å; S74-R76 PolarHBondContact OG-O 2.76Å; S74-F78 WeakPolarHBondContact OG-CE2 3.32Å; S74-L171 VanDerWaalsContact CB-CD2 3.46Å; S74-G173 CarbonylContact O-C 3.59Å; S74-G173 WeakPolarHBondContact O-CA 3.49Å; S74-L174 WeakPolarHBondContact O-CB 3.26Å; S74-L174 PolarHBondContact O-N 3.1Å
75	Q	86.3	Confident	93.3	Very high	78 Å²	78	29.3 Å²	29.3	36%	0.364	16%	0.157	S	C	.	.	S	Bend	trans	-78.7	-19.8	173.3	-72.8	-172.6	-32.4	0	0	113.9	A220 L221	Q75-A220 PolarHBondContact N-O 3.42Å; Q75-L221 HydrophobicContact CG-CD1 4.43Å; Q75-L221 VanDerWaalsContact NE2-CD1 3.28Å
76	R	92.3	Very high	93.3	Very high	95 Å²	95	32.3 Å²	32.3	36%	0.358	16%	0.162	S	C	.	.	S	Bend	trans	-127.2	155.3	-176.8	-71.2	-67.7	-170.6	-91	-1.4	111.6	S74 F78 L138 L171 G173 D175 V222	S74-R76 VanDerWaalsContact C-N 3.34Å; S74-R76 PolarHBondContact OG-N 3.18Å; S74-R76 PolarHBondContact OG-O 2.76Å; R76-F78 HydrophobicContact CB-CE2 4.18Å; R76-F78 HydrophobicContact CB-CZ 4.09Å; R76-F78 WeakPolarHBondContact O-CD2 3.15Å; R76-F78 WeakPolarHBondContact O-CE2 3.48Å; R76-L138 HydrophobicContact CG-CD1 4.48Å; R76-L171 WeakPolarHBondContact O-CD2 3.16Å; R76-G173 WeakPolarHBondContact O-CA 3.34Å; R76-D175 VanDerWaalsContact CA-OD2 3.27Å; R76-D175 WeakPolarHBondContact CA-OD2 2.99Å; R76-V222 HydrophobicContact CB-CB 4.4Å; R76-V222 HydrophobicContact CB-CG2 3.79Å; R76-V222 HydrophobicContact CG-CB 3.68Å; R76-V222 HydrophobicContact CG-CG1 4.21Å; R76-V222 HydrophobicContact CG-CG2 3.64Å
77	S	95.7	Very high	93.2	Very high	1 Å²	1	33 Å²	33	1%	0.007	17%	0.165	C	C	.	.			trans	-87.9	146.8	169.8	-65.8	0	0	0	0	111.5	A137 L138 L171 I172 G173 D175 Y176	S77-A137 VanDerWaalsContact O-CA 3.28Å; S77-A137 WeakPolarHBondContact O-CA 3.11Å; S77-L138 PolarHBondContact O-N 3.47Å; S77-L171 CarbonylContact C-O 3.59Å; S77-L171 WeakPolarHBondContact CA-O 3.49Å; S77-L171 WeakPolarHBondContact CB-O 3.35Å; S77-I172 WeakPolarHBondContact OG-CA 3.42Å; S77-G173 PolarHBondContact OG-N 2.9Å; S77-D175 PolarHBondContact N-OD1 2.8Å; S77-D175 PolarHBondContact N-OD2 3.21Å; S77-D175 PolarHBondContact OG-OD1 2.93Å; S77-Y176 WeakPolarHBondContact OG-CD2 3.18Å
78	F	95.8	Very high	93	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.013	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.3	-176.9	-59.9	-84.7	0	0	0	111.8	S74 R76 I98 L138 L140 I143 V170 L171 A220 V222	S74-F78 WeakPolarHBondContact OG-CE2 3.32Å; R76-F78 HydrophobicContact CB-CE2 4.18Å; R76-F78 HydrophobicContact CB-CZ 4.09Å; R76-F78 WeakPolarHBondContact O-CD2 3.15Å; R76-F78 WeakPolarHBondContact O-CE2 3.48Å; F78-I98 HydrophobicContact CE1-CD1 3.79Å; F78-I98 HydrophobicContact CZ-CD1 4.21Å; F78-L138 VanDerWaalsContact CA-O 3.27Å; F78-L138 WeakPolarHBondContact CA-O 3.36Å; F78-L138 HydrophobicContact CD1-CB 3.72Å; F78-L138 HydrophobicContact CE1-CB 3.91Å; F78-L138 HydrophobicContact CE1-CD1 4.01Å; F78-L140 HydrophobicContact CB-CD1 3.97Å; F78-L140 HydrophobicContact CB-CG 4.42Å; F78-L140 HydrophobicContact CD1-CD1 3.34Å; F78-L140 HydrophobicContact CD1-CG 3.62Å; F78-L140 HydrophobicContact CD2-CD1 4.26Å; F78-L140 HydrophobicContact CE1-CD1 3.79Å; F78-L140 HydrophobicContact CE1-CG 4.17Å; F78-L140 HydrophobicContact CG-CD1 3.6Å; F78-L140 HydrophobicContact CG-CG 4.23Å; F78-L140 HydrophobicContact CZ-CD1 4.39Å; F78-I143 HydrophobicContact CB-CD1 4.46Å; F78-I143 HydrophobicContact CB-CG1 4.39Å; F78-V170 CarbonylContact O-C 3.53Å; F78-V170 WeakPolarHBondContact O-CA 3.5Å; F78-L171 HydrophobicContact CB-CB 4.26Å; F78-L171 HydrophobicContact CD2-CB 4.45Å; F78-L171 HydrophobicContact CD2-CD2 3.9Å; F78-L171 PolarHBondContact N-O 3.18Å; F78-L171 PolarHBondContact O-N 3.15Å; F78-A220 HydrophobicContact CE2-CB 3.87Å; F78-A220 HydrophobicContact CZ-CB 4.19Å; F78-V222 HydrophobicContact CE1-CG2 4.29Å; F78-V222 HydrophobicContact CZ-CG2 3.6Å
79	I	97.2	Very high	92.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.2	173.3	-175.5	164.3	0	0	0	109.5	M56 L83 A84 L89 V114 F116 A137 L138 W139 L140 V170	M56-I79 HydrophobicContact SD-CD1 4.01Å; I79-L83 HydrophobicContact CD1-CB 4.49Å; I79-L83 HydrophobicContact CD1-CD2 3.73Å; I79-L83 HydrophobicContact CD1-CG 4Å; I79-L83 HydrophobicContact CG1-CB 4.28Å; I79-L83 HydrophobicContact CG1-CD2 3.91Å; I79-L83 HydrophobicContact CG1-CG 4.26Å; I79-A84 HydrophobicContact CD1-CB 4.26Å; I79-A84 HydrophobicContact CG1-CB 4.33Å; I79-A84 HydrophobicContact CG2-CB 4.29Å; I79-L89 HydrophobicContact CD1-CD1 3.69Å; I79-V114 HydrophobicContact CG2-CG2 3.71Å; I79-F116 HydrophobicContact CB-CE1 4.12Å; I79-F116 HydrophobicContact CD1-CD1 4.04Å; I79-F116 HydrophobicContact CD1-CE1 3.67Å; I79-F116 HydrophobicContact CD1-CZ 4.22Å; I79-F116 HydrophobicContact CG1-CE1 4.46Å; I79-F116 HydrophobicContact CG2-CE1 4.42Å; I79-A137 HydrophobicContact CB-CB 4.23Å; I79-A137 HydrophobicContact CG2-CB 4.08Å; I79-L138 PolarHBondContact N-O 3.28Å; I79-W139 HydrophobicContact CG2-CG 4.46Å; I79-W139 WeakPolarHBondContact O-CA 3.19Å; I79-L140 PolarHBondContact O-N 3.26Å; I79-V170 HydrophobicContact CD1-CG2 4.43Å; I79-V170 HydrophobicContact CG1-CG2 4.27Å
80	T	95.3	Very high	92.6	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	138.7	175	58.4	0	0	0	0	111.6	E82 L83 A84 L140 I143 I168 D169	T80-E82 PolarHBondContact O-N 3.35Å; T80-L83 PolarHBondContact O-N 3.29Å; T80-L83 VanDerWaalsContact O-N 3.12Å; T80-L83 VanDerWaalsContact OG1-CB 3.31Å; T80-L83 WeakPolarHBondContact OG1-CB 3.35Å; T80-L83 PolarHBondContact OG1-N 3.5Å; T80-A84 PolarHBondContact O-N 3.16Å; T80-L140 CarbonylContact C-O 3.37Å; T80-L140 WeakPolarHBondContact CA-O 3.37Å; T80-I143 HydrophobicContact CG2-CD1 3.86Å; T80-I143 HydrophobicContact CG2-CG1 4.01Å; T80-I168 WeakPolarHBondContact CG2-O 3.31Å; T80-D169 PolarHBondContact N-O 3.09Å; T80-D169 PolarHBondContact OG1-O 3.48Å
81	E	92.6	Very high	92.3	Very high	52 Å²	52	43.9 Å²	43.9	24%	0.243	23%	0.233	C	C	.	.	H	α-helix	trans	-55.4	-39.1	174.7	-75.6	175.1	173.5	0	0	111.8	L83 A84 N85 K109 W139 L140 S141	E81-L83 PolarHBondContact O-N 3.08Å; E81-A84 PolarHBondContact O-N 2.89Å; E81-N85 VanDerWaalsContact O-CB 3.27Å; E81-N85 WeakPolarHBondContact O-CB 3.4Å; E81-N85 VanDerWaalsContact O-CG 3.24Å; E81-N85 PolarHBondContact O-N 3.45Å; E81-N85 PolarHBondContact O-ND2 3.31Å; E81-N85 VanDerWaalsContact O-ND2 3.13Å; E81-K109 WeakPolarHBondContact OE1-CE 3.44Å; E81-K109 IonicContact OE1-NZ 3.75Å; E81-K109 PolarHBondContact OE1-NZ 3.46Å; E81-K109 IonicContact OE2-NZ 2.58Å; E81-W139 HydrophobicContact CG-CB 3.96Å; E81-W139 HydrophobicContact CG-CD2 4.48Å; E81-W139 HydrophobicContact CG-CE3 3.98Å; E81-L140 PolarHBondContact N-O 2.92Å; E81-S141 WeakPolarHBondContact OE2-CA 3.25Å; E81-S141 WeakPolarHBondContact OE2-CB 3.47Å
82	E	94.4	Very high	92.1	Very high	103 Å²	103	46.1 Å²	46.1	48%	0.481	25%	0.249	S	C	.	.	H	α-helix	trans	-57.5	-49.1	176	-173.4	-166.7	145.1	0	0	111.9	T80 R86 K167	T80-E82 PolarHBondContact O-N 3.35Å; E82-R86 WeakPolarHBondContact O-CB 3.01Å; E82-R86 PolarHBondContact O-N 3Å; E82-R86 IonicContact OE1-NH1 2.79Å; E82-K167 IonicContact OE2-NZ 3.77Å; E82-K167 PolarHBondContact OE2-NZ 3.12Å
83	L	96.6	Very high	91.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.4	-43.7	178.3	175.2	64.5	0	0	0	111.2	M56 T64 V66 I79 T80 E81 N85 R86 M87 D169 V170	M56-L83 HydrophobicContact CE-CD1 4.12Å; M56-L83 HydrophobicContact CE-CD2 4.15Å; M56-L83 HydrophobicContact CE-CG 4.13Å; M56-L83 HydrophobicContact SD-CD2 3.93Å; T64-L83 HydrophobicContact CG2-CD1 3.97Å; V66-L83 HydrophobicContact CB-CD2 4.45Å; V66-L83 HydrophobicContact CG1-CD1 4.13Å; V66-L83 HydrophobicContact CG1-CD2 3.6Å; I79-L83 HydrophobicContact CD1-CB 4.49Å; I79-L83 HydrophobicContact CD1-CD2 3.73Å; I79-L83 HydrophobicContact CD1-CG 4Å; I79-L83 HydrophobicContact CG1-CB 4.28Å; I79-L83 HydrophobicContact CG1-CD2 3.91Å; I79-L83 HydrophobicContact CG1-CG 4.26Å; T80-L83 PolarHBondContact O-N 3.29Å; T80-L83 VanDerWaalsContact O-N 3.12Å; T80-L83 VanDerWaalsContact OG1-CB 3.31Å; T80-L83 WeakPolarHBondContact OG1-CB 3.35Å; T80-L83 PolarHBondContact OG1-N 3.5Å; E81-L83 PolarHBondContact O-N 3.08Å; L83-N85 VanDerWaalsContact C-N 3.33Å; L83-N85 PolarHBondContact O-N 3.48Å; L83-R86 VanDerWaalsContact CD1-NH2 3.26Å; L83-R86 PolarHBondContact O-N 3.43Å; L83-M87 HydrophobicContact CD1-CG 3.75Å; L83-M87 WeakPolarHBondContact O-CB 3.49Å; L83-M87 PolarHBondContact O-N 3.23Å; L83-D169 HydrophobicContact CD2-CB 3.63Å; L83-V170 HydrophobicContact CD2-CG2 3.94Å
84	A	95	Very high	91.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-38	-177.3	0	0	0	0	0	112.1	I79 T80 E81 M87 P88 L89 W139	I79-A84 HydrophobicContact CD1-CB 4.26Å; I79-A84 HydrophobicContact CG1-CB 4.33Å; I79-A84 HydrophobicContact CG2-CB 4.29Å; T80-A84 PolarHBondContact O-N 3.16Å; E81-A84 PolarHBondContact O-N 2.89Å; A84-M87 CarbonylContact O-C 3.59Å; A84-M87 PolarHBondContact O-N 2.68Å; A84-P88 WeakPolarHBondContact O-CA 3.33Å; A84-L89 HydrophobicContact CB-CB 4.44Å; A84-L89 HydrophobicContact CB-CD1 4.37Å; A84-L89 PolarHBondContact O-N 3.19Å; A84-W139 HydrophobicContact CB-CD2 3.97Å; A84-W139 HydrophobicContact CB-CG 4.37Å; A84-W139 HydrophobicContact CB-CH2 4.2Å; A84-W139 HydrophobicContact CB-CZ2 3.46Å; A84-W139 VanDerWaalsContact CB-CZ2 3.46Å
85	N	93.9	Very high	90.8	Very high	102 Å²	102	50.3 Å²	50.3	55%	0.545	25%	0.253	S	S	.	.	H	α-helix	trans	-68.2	-42	172.7	-74.8	-32.2	0	0	0	112.1	E81 L83 M87 W139	E81-N85 VanDerWaalsContact O-CB 3.27Å; E81-N85 WeakPolarHBondContact O-CB 3.4Å; E81-N85 VanDerWaalsContact O-CG 3.24Å; E81-N85 PolarHBondContact O-N 3.45Å; E81-N85 PolarHBondContact O-ND2 3.31Å; E81-N85 VanDerWaalsContact O-ND2 3.13Å; L83-N85 VanDerWaalsContact C-N 3.33Å; L83-N85 PolarHBondContact O-N 3.48Å; N85-M87 PolarHBondContact O-N 3.08Å; N85-W139 WeakPolarHBondContact OD1-CH2 3.39Å; N85-W139 WeakPolarHBondContact OD1-CZ3 3.4Å
86	R	94.8	Very high	90.3	Very high	125 Å²	125	46.9 Å²	46.9	47%	0.472	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-31.8	177.1	-175.1	173.5	69.5	-140.2	4.8	112.5	E82 L83 P88	E82-R86 WeakPolarHBondContact O-CB 3.01Å; E82-R86 PolarHBondContact O-N 3Å; E82-R86 IonicContact OE1-NH1 2.79Å; L83-R86 VanDerWaalsContact CD1-NH2 3.26Å; L83-R86 PolarHBondContact O-N 3.43Å; R86-P88 VanDerWaalsContact C-CD 3.47Å; R86-P88 WeakPolarHBondContact O-CD 3.3Å
87	M	94.7	Very high	89.5	Confident	17 Å²	17	43.7 Å²	43.7	8%	0.084	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	47.1	-178.3	-64.3	-66.6	-65.7	0	0	111.3	M56 T58 D62 T64 L83 A84 N85 L89	M56-M87 HydrophobicContact CE-CB 3.61Å; M56-M87 HydrophobicContact CE-CE 4Å; M56-M87 HydrophobicContact CE-CG 3.48Å; M56-M87 VanDerWaalsContact CE-CG 3.48Å; T58-M87 HydrophobicContact CG2-CB 3.98Å; T58-M87 HydrophobicContact CG2-CE 3.6Å; D62-M87 HydrophobicContact CB-CE 3.9Å; T64-M87 HydrophobicContact CG2-CE 3.69Å; T64-M87 HydrophobicContact CG2-CG 3.85Å; T64-M87 HydrophobicContact CG2-SD 3.58Å; T64-M87 VanDerWaalsContact CG2-SD 3.58Å; L83-M87 HydrophobicContact CD1-CG 3.75Å; L83-M87 WeakPolarHBondContact O-CB 3.49Å; L83-M87 PolarHBondContact O-N 3.23Å; A84-M87 CarbonylContact O-C 3.59Å; A84-M87 PolarHBondContact O-N 2.68Å; N85-M87 PolarHBondContact O-N 3.08Å; M87-L89 HydrophobicContact CB-CG 4.42Å; M87-L89 WeakPolarHBondContact O-CA 3.43Å; M87-L89 WeakPolarHBondContact O-CD2 3.43Å; M87-L89 WeakPolarHBondContact O-CG 3.36Å; M87-L89 PolarHBondContact O-N 2.94Å
88	P	90.3	Very high	88.6	Confident	92 Å²	92	44.3 Å²	44.3	60%	0.597	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-21.1	68.9	-152.1	20.1	-37.1	0	0	0	115.5	A84 R86	A84-P88 WeakPolarHBondContact O-CA 3.33Å; R86-P88 VanDerWaalsContact C-CD 3.47Å; R86-P88 WeakPolarHBondContact O-CD 3.3Å
89	L	93.4	Very high	87.6	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.234	C	C	.	.			trans	-78	135.2	-177.6	-66.3	-178.8	0	0	0	107.8	T58 I79 A84 M87 V114 F116 W139	T58-L89 HydrophobicContact CG2-CD2 3.75Å; I79-L89 HydrophobicContact CD1-CD1 3.69Å; A84-L89 HydrophobicContact CB-CB 4.44Å; A84-L89 HydrophobicContact CB-CD1 4.37Å; A84-L89 PolarHBondContact O-N 3.19Å; M87-L89 HydrophobicContact CB-CG 4.42Å; M87-L89 WeakPolarHBondContact O-CA 3.43Å; M87-L89 WeakPolarHBondContact O-CD2 3.43Å; M87-L89 WeakPolarHBondContact O-CG 3.36Å; M87-L89 PolarHBondContact O-N 2.94Å; L89-V114 HydrophobicContact CB-CB 3.96Å; L89-V114 HydrophobicContact CB-CG1 3.89Å; L89-V114 HydrophobicContact CB-CG2 4.26Å; L89-V114 HydrophobicContact CD1-CB 4.23Å; L89-V114 HydrophobicContact CD1-CG2 3.8Å; L89-F116 HydrophobicContact CD1-CB 4.4Å; L89-F116 HydrophobicContact CD1-CD1 3.82Å; L89-F116 HydrophobicContact CD1-CG 4.48Å; L89-F116 HydrophobicContact CD2-CB 4.49Å; L89-W139 VanDerWaalsContact O-CZ2 3.23Å; L89-W139 WeakPolarHBondContact O-CZ2 3.2Å
90	N	88.4	Confident	86.5	Confident	126 Å²	126	48.2 Å²	48.2	67%	0.674	25%	0.253	S	S	*	.			trans	-124.6	157.2	176	-81.1	-51.2	0	0	0	110.3
91	G	89.6	Confident	85.3	Confident	23 Å²	23	53.8 Å²	53.8	24%	0.237	28%	0.282	C	S	.	.			trans	173.2	175.4	179.5	0	0	0	0	0	111.9	R112 R113	G91-R112 PolarHBondContact O-NH1 2.84Å; G91-R113 VanDerWaalsContact CA-O 3.31Å; G91-R113 WeakPolarHBondContact CA-O 3.36Å
92	P	87.9	Confident	84.2	Confident	68 Å²	68	54.6 Å²	54.6	44%	0.442	30%	0.304	S	S	.	.			trans	-62.3	146.7	-174.3	26.4	-34.8	0	0	0	111.7	R112 R113	P92-R112 VanDerWaalsContact O-CA 3.31Å; P92-R112 WeakPolarHBondContact O-CA 3.47Å; P92-R113 WeakPolarHBondContact CD-O 3.31Å; P92-R113 HydrophobicContact CG-CB 4.44Å; P92-R113 PolarHBondContact O-N 2.81Å
93	L	81.9	Confident	82.7	Confident	78 Å²	78	51.3 Å²	51.3	41%	0.408	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.2	169.8	-75.2	165.2	0	0	0	109.3	R110 T111 R112	L93-R110 HydrophobicContact CB-CG 4.49Å; L93-R110 HydrophobicContact CD2-CG 4.39Å; L93-T111 CarbonylContact C-O 3.53Å; L93-T111 VanDerWaalsContact CA-O 3.32Å; L93-T111 WeakPolarHBondContact CA-O 3.38Å; L93-R112 HydrophobicContact CD2-CG 3.53Å; L93-R112 HydrophobicContact CG-CG 4.2Å
94	E	75.7	Confident	80.9	Confident	24 Å²	24	60.3 Å²	60.3	11%	0.112	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147.1	-176.9	-57.2	-171	160.8	0	0	110	R110 T111 R113	E94-R110 CarbonylContact O-C 3.54Å; E94-R110 WeakPolarHBondContact O-CA 3.17Å; E94-T111 PolarHBondContact N-O 2.94Å; E94-T111 PolarHBondContact O-N 3.34Å; E94-R113 IonicContact OE1-CZ 2.65Å; E94-R113 IonicContact OE1-NE 3.15Å; E94-R113 IonicContact OE1-NH1 2.72Å; E94-R113 PolarHBondContact OE1-NH1 3.15Å; E94-R113 IonicContact OE1-NH2 3.5Å; E94-R113 PolarHBondContact OE1-NH2 3.18Å; E94-R113 IonicContact OE2-CZ 3.04Å; E94-R113 IonicContact OE2-NH1 2.68Å; E94-R113 PolarHBondContact OE2-NH1 2.94Å
95	Y	74.7	Confident	79.1	Confident	59 Å²	59	63 Å²	63	23%	0.231	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.7	173.6	-76.5	-96.2	0	0	0	108.8	R110 D225 E228	Y95-R110 HydrophobicContact CD1-CB 4.03Å; Y95-R110 HydrophobicContact CD1-CG 4.43Å; Y95-R110 HydrophobicContact CD2-CG 4.14Å; Y95-R110 HydrophobicContact CE1-CB 3.73Å; Y95-R110 HydrophobicContact CE1-CG 4.1Å; Y95-R110 HydrophobicContact CE2-CB 4.32Å; Y95-R110 HydrophobicContact CE2-CG 3.76Å; Y95-R110 HydrophobicContact CG-CB 4.47Å; Y95-R110 HydrophobicContact CG-CG 4.47Å; Y95-R110 WeakPolarHBondContact OH-CD 3.34Å; Y95-D225 WeakPolarHBondContact O-CB 3.3Å; Y95-D225 PolarHBondContact O-N 2.86Å; Y95-E228 PolarHBondContact N-OE2 3.17Å
96	V	76.9	Confident	77.5	Confident	6 Å²	6	62.5 Å²	62.5	4%	0.036	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139	-179.4	-59.2	0	0	0	0	110.8	I98 C108 K109 T111 L138 V222	V96-I98 HydrophobicContact CG2-CD1 4.29Å; V96-I98 HydrophobicContact CG2-CG1 4.19Å; V96-C108 WeakPolarHBondContact O-CA 3.26Å; V96-K109 PolarHBondContact N-O 3.06Å; V96-K109 PolarHBondContact O-N 2.77Å; V96-T111 HydrophobicContact CG1-CG2 4.21Å; V96-T111 HydrophobicContact CG2-CG2 3.55Å; V96-L138 HydrophobicContact CB-CD1 4.47Å; V96-L138 HydrophobicContact CG1-CD1 3.93Å; V96-L138 HydrophobicContact CG1-CD2 4.19Å; V96-L138 HydrophobicContact CG2-CD1 4.41Å; V96-V222 HydrophobicContact CB-CG1 4Å; V96-V222 HydrophobicContact CG1-CG1 4.23Å
97	E	73.9	Confident	75.9	Confident	28 Å²	28	61.9 Å²	61.9	13%	0.131	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.7	168	-65.5	-170	153	0	0	109.6	F99 C108 V222 K223	E97-F99 HydrophobicContact CB-CD2 4.47Å; E97-F99 HydrophobicContact CB-CE2 3.67Å; E97-F99 HydrophobicContact CB-CZ 4.2Å; E97-F99 WeakPolarHBondContact OE2-CZ 3.25Å; E97-C108 HydrophobicContact CG-CB 4.46Å; E97-V222 WeakPolarHBondContact O-CA 3.42Å; E97-K223 HydrophobicContact CB-CB 4.43Å; E97-K223 PolarHBondContact N-O 3.28Å; E97-K223 VanDerWaalsContact N-O 3.1Å; E97-K223 PolarHBondContact O-N 3.47Å
98	I	77.2	Confident	74.3	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.077	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.3	178.3	-54.2	175.5	0	0	0	108.9	F78 V96 Y107 L140 A220 V222	F78-I98 HydrophobicContact CE1-CD1 3.79Å; F78-I98 HydrophobicContact CZ-CD1 4.21Å; V96-I98 HydrophobicContact CG2-CD1 4.29Å; V96-I98 HydrophobicContact CG2-CG1 4.19Å; I98-Y107 PolarHBondContact N-O 3.08Å; I98-Y107 PolarHBondContact O-N 3.41Å; I98-L140 HydrophobicContact CD1-CD1 4.39Å; I98-L140 HydrophobicContact CD1-CD2 3.6Å; I98-L140 HydrophobicContact CD1-CG 4.43Å; I98-A220 HydrophobicContact CG2-CB 4.21Å; I98-V222 HydrophobicContact CG1-CG2 4.36Å
99	F	75	Confident	73.3	Confident	23 Å²	23	61.6 Å²	61.6	10%	0.101	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.3	176	-58	-102	0	0	0	109.9	E97 K106 A220 L221 K223	E97-F99 HydrophobicContact CB-CD2 4.47Å; E97-F99 HydrophobicContact CB-CE2 3.67Å; E97-F99 HydrophobicContact CB-CZ 4.2Å; E97-F99 WeakPolarHBondContact OE2-CZ 3.25Å; F99-K106 HydrophobicContact CD1-CG 3.98Å; F99-K106 HydrophobicContact CE1-CD 3.83Å; F99-K106 HydrophobicContact CE1-CG 3.69Å; F99-K106 HydrophobicContact CZ-CD 4.45Å; F99-A220 WeakPolarHBondContact O-CA 3.19Å; F99-L221 HydrophobicContact CB-CB 4.18Å; F99-L221 HydrophobicContact CB-CD2 4.43Å; F99-L221 HydrophobicContact CD2-CD2 4.06Å; F99-L221 HydrophobicContact CD2-CG 4.49Å; F99-L221 HydrophobicContact CG-CD2 4.32Å; F99-L221 PolarHBondContact N-O 2.86Å; F99-L221 PolarHBondContact O-N 3.39Å; F99-L221 VanDerWaalsContact O-N 3.11Å; F99-K223 HydrophobicContact CD2-CG 4.46Å; F99-K223 HydrophobicContact CE2-CB 4.26Å; F99-K223 HydrophobicContact CE2-CD 3.74Å; F99-K223 HydrophobicContact CE2-CG 3.89Å; F99-K223 HydrophobicContact CZ-CD 4.17Å
100	T	74.1	Confident	72.5	Confident	62 Å²	62	67.5 Å²	67.5	38%	0.38	37%	0.369	S	S	.	.			trans	-99.3	178.2	172	84.2	0	0	0	0	111.5	G102 G103 S105 H219	T100-G102 PolarHBondContact O-N 3.19Å; T100-G103 PolarHBondContact O-N 3.34Å; T100-S105 WeakPolarHBondContact CG2-OG 3.4Å; T100-S105 PolarHBondContact OG1-OG 3.03Å; T100-H219 WeakPolarHBondContact CA-O 3.49Å
101	L	70.1	Confident	72.3	Confident	117 Å²	117	61.7 Å²	61.7	61%	0.613	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	127.5	-179.6	-164.1	84	0	0	0	111.4	S217 H219	L101-S217 WeakPolarHBondContact CD2-OG 3.34Å; L101-H219 HydrophobicContact CB-CB 4.36Å; L101-H219 HydrophobicContact CD1-CB 4.37Å
102	G	68.9	Low	72.3	Confident	69 Å²	69	64.3 Å²	64.3	71%	0.711	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	-8.4	-178.9	0	0	0	0	0	114.6	T100 Q104	T100-G102 PolarHBondContact O-N 3.19Å; G102-Q104 PolarHBondContact O-N 2.96Å
103	G	64.6	Low	72.5	Confident	34 Å²	34	65.1 Å²	65.1	35%	0.351	34%	0.335	S	S	.	.	S	Bend	trans	67.7	-2.7	173.4	0	0	0	0	0	115.8	T100	T100-G103 PolarHBondContact O-N 3.34Å
104	Q	58.5	Low	73.1	Confident	188 Å²	188	61.6 Å²	61.6	88%	0.879	32%	0.317	S	S	*	.			trans	-73.7	-33.6	-177.6	-70.3	-88.1	-48.5	0	0	112.3	G102	G102-Q104 PolarHBondContact O-N 2.96Å
105	S	56.5	Low	74.2	Confident	57 Å²	57	64.3 Å²	64.3	40%	0.399	33%	0.329	S	S	.	.			trans	-95	105.2	172.9	71.2	0	0	0	0	109.4	T100	T100-S105 WeakPolarHBondContact CG2-OG 3.4Å; T100-S105 PolarHBondContact OG1-OG 3.03Å
106	K	60.5	Low	75.3	Confident	92 Å²	92	61.5 Å²	61.5	40%	0.4	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.7	165.5	-57.2	-176.6	-165.5	168.7	0	108	F99 E460 H461	F99-K106 HydrophobicContact CD1-CG 3.98Å; F99-K106 HydrophobicContact CE1-CD 3.83Å; F99-K106 HydrophobicContact CE1-CG 3.69Å; F99-K106 HydrophobicContact CZ-CD 4.45Å; K106-E460 IonicContact NZ-OE2 2.7Å; K106-E460 PolarHBondContact NZ-OE2 3.07Å; K106-H461 PolarHBondContact NZ-NE2 3.03Å
107	Y	62.2	Low	76.2	Confident	112 Å²	112	61.4 Å²	61.4	44%	0.439	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	99.8	172.9	-171.9	-111.9	0	0	0	107.9	I98 K109	I98-Y107 PolarHBondContact N-O 3.08Å; I98-Y107 PolarHBondContact O-N 3.41Å; Y107-K109 HydrophobicContact CD1-CB 4.02Å; Y107-K109 HydrophobicContact CD1-CD 4.47Å; Y107-K109 HydrophobicContact CE1-CB 3.67Å; Y107-K109 HydrophobicContact CE1-CD 3.42Å; Y107-K109 VanDerWaalsContact CE1-CD 3.42Å; Y107-K109 HydrophobicContact CE1-CG 4.14Å
108	C	60.4	Low	77.3	Confident	72 Å²	72	60 Å²	60	49%	0.486	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.8	170.6	-171.4	0	0	0	0	108.2	V96 E97	V96-C108 WeakPolarHBondContact O-CA 3.26Å; E97-C108 HydrophobicContact CG-CB 4.46Å
109	K	68.9	Low	78.1	Confident	31 Å²	31	59.3 Å²	59.3	14%	0.135	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	134.2	-178.6	178.6	168.5	-177.9	169.1	0	111.2	E81 V96 Y107 T111	E81-K109 WeakPolarHBondContact OE1-CE 3.44Å; E81-K109 IonicContact OE1-NZ 3.75Å; E81-K109 PolarHBondContact OE1-NZ 3.46Å; E81-K109 IonicContact OE2-NZ 2.58Å; V96-K109 PolarHBondContact N-O 3.06Å; V96-K109 PolarHBondContact O-N 2.77Å; Y107-K109 HydrophobicContact CD1-CB 4.02Å; Y107-K109 HydrophobicContact CD1-CD 4.47Å; Y107-K109 HydrophobicContact CE1-CB 3.67Å; Y107-K109 HydrophobicContact CE1-CD 3.42Å; Y107-K109 VanDerWaalsContact CE1-CD 3.42Å; Y107-K109 HydrophobicContact CE1-CG 4.14Å; K109-T111 PolarHBondContact O-N 3.28Å
110	R	76.1	Confident	78.9	Confident	133 Å²	133	59.1 Å²	59.1	50%	0.502	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	111.5	159.3	-162.3	-177.5	-174.6	-179.9	-3.7	108.5	L93 E94 Y95	L93-R110 HydrophobicContact CB-CG 4.49Å; L93-R110 HydrophobicContact CD2-CG 4.39Å; E94-R110 CarbonylContact O-C 3.54Å; E94-R110 WeakPolarHBondContact O-CA 3.17Å; Y95-R110 HydrophobicContact CD1-CB 4.03Å; Y95-R110 HydrophobicContact CD1-CG 4.43Å; Y95-R110 HydrophobicContact CD2-CG 4.14Å; Y95-R110 HydrophobicContact CE1-CB 3.73Å; Y95-R110 HydrophobicContact CE1-CG 4.1Å; Y95-R110 HydrophobicContact CE2-CB 4.32Å; Y95-R110 HydrophobicContact CE2-CG 3.76Å; Y95-R110 HydrophobicContact CG-CB 4.47Å; Y95-R110 HydrophobicContact CG-CG 4.47Å; Y95-R110 WeakPolarHBondContact OH-CD 3.34Å
111	T	84.3	Confident	79.4	Confident	5 Å²	5	59 Å²	59	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	171.4	-175.6	-165.4	0	0	0	0	110.9	L93 E94 V96 K109 L138 W139	L93-T111 CarbonylContact C-O 3.53Å; L93-T111 VanDerWaalsContact CA-O 3.32Å; L93-T111 WeakPolarHBondContact CA-O 3.38Å; E94-T111 PolarHBondContact N-O 2.94Å; E94-T111 PolarHBondContact O-N 3.34Å; V96-T111 HydrophobicContact CG1-CG2 4.21Å; V96-T111 HydrophobicContact CG2-CG2 3.55Å; K109-T111 PolarHBondContact O-N 3.28Å; T111-L138 HydrophobicContact CG2-CB 4.17Å; T111-L138 HydrophobicContact CG2-CD2 3.87Å; T111-L138 HydrophobicContact CG2-CG 4.49Å; T111-W139 WeakPolarHBondContact OG1-CA 3.38Å; T111-W139 VanDerWaalsContact OG1-CB 3.25Å; T111-W139 WeakPolarHBondContact OG1-CB 3.29Å; T111-W139 PolarHBondContact OG1-N 3.31Å; T111-W139 PolarHBondContact OG1-O 3.36Å
112	R	89.4	Confident	79.4	Confident	77 Å²	77	61 Å²	61	29%	0.291	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.5	174.6	-67.6	-178	-179.2	-86.6	3.9	110.8	G91 P92 L93 V114 L138 W139	G91-R112 PolarHBondContact O-NH1 2.84Å; P92-R112 VanDerWaalsContact O-CA 3.31Å; P92-R112 WeakPolarHBondContact O-CA 3.47Å; L93-R112 HydrophobicContact CD2-CG 3.53Å; L93-R112 HydrophobicContact CG-CG 4.2Å; R112-V114 HydrophobicContact CB-CG1 4.29Å; R112-L138 WeakPolarHBondContact O-CA 3.35Å; R112-W139 HydrophobicContact CB-CD2 3.92Å; R112-W139 HydrophobicContact CB-CE3 4.44Å; R112-W139 HydrophobicContact CB-CG 4.07Å; R112-W139 HydrophobicContact CG-CD2 4.47Å; R112-W139 PolarHBondContact O-N 3.44Å
113	R	92.4	Very high	78.8	Confident	86 Å²	86	59.5 Å²	59.5	33%	0.325	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.4	160.5	-176.2	170.6	63.8	-119.5	-12.7	108.6	G91 P92 E94 E136 A137 L138	G91-R113 VanDerWaalsContact CA-O 3.31Å; G91-R113 WeakPolarHBondContact CA-O 3.36Å; P92-R113 WeakPolarHBondContact CD-O 3.31Å; P92-R113 HydrophobicContact CG-CB 4.44Å; P92-R113 PolarHBondContact O-N 2.81Å; E94-R113 IonicContact OE1-CZ 2.65Å; E94-R113 IonicContact OE1-NE 3.15Å; E94-R113 IonicContact OE1-NH1 2.72Å; E94-R113 PolarHBondContact OE1-NH1 3.15Å; E94-R113 IonicContact OE1-NH2 3.5Å; E94-R113 PolarHBondContact OE1-NH2 3.18Å; E94-R113 IonicContact OE2-CZ 3.04Å; E94-R113 IonicContact OE2-NH1 2.68Å; E94-R113 PolarHBondContact OE2-NH1 2.94Å; R113-E136 HydrophobicContact CG-CB 4.27Å; R113-E136 IonicContact NE-OE2 3.07Å; R113-A137 WeakPolarHBondContact CA-O 3.29Å; R113-L138 HydrophobicContact CB-CD2 4.08Å
114	V	95.6	Very high	78.2	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	158.3	179.4	-66.1	0	0	0	0	111.5	I79 L89 R112 F116 E136 A137 W139	I79-V114 HydrophobicContact CG2-CG2 3.71Å; L89-V114 HydrophobicContact CB-CB 3.96Å; L89-V114 HydrophobicContact CB-CG1 3.89Å; L89-V114 HydrophobicContact CB-CG2 4.26Å; L89-V114 HydrophobicContact CD1-CB 4.23Å; L89-V114 HydrophobicContact CD1-CG2 3.8Å; R112-V114 HydrophobicContact CB-CG1 4.29Å; V114-F116 HydrophobicContact CG2-CD1 4.45Å; V114-E136 CarbonylContact O-C 3.59Å; V114-E136 VanDerWaalsContact O-CA 3.29Å; V114-E136 WeakPolarHBondContact O-CA 3.25Å; V114-A137 PolarHBondContact N-O 3.29Å; V114-A137 PolarHBondContact O-N 3.16Å; V114-W139 HydrophobicContact CG1-CZ2 4.08Å; V114-W139 VanDerWaalsContact CG2-NE1 3.26Å
115	Q	97.2	Very high	77.7	Confident	82 Å²	82	59.1 Å²	59.1	38%	0.383	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.3	-177.4	-160.4	-176	68.1	0	0	110.8	M59 T134 V135 E136	M59-Q115 HydrophobicContact CE-CB 3.93Å; M59-Q115 HydrophobicContact CE-CG 3.56Å; M59-Q115 VanDerWaalsContact CE-OE1 3.31Å; Q115-T134 VanDerWaalsContact CD-CG2 3.47Å; Q115-T134 HydrophobicContact CG-CG2 3.32Å; Q115-V135 WeakPolarHBondContact CA-O 3.44Å; Q115-E136 HydrophobicContact CB-CG 4.33Å; Q115-E136 HydrophobicContact CG-CG 3.94Å; Q115-E136 PolarHBondContact NE2-OE1 3.24Å
116	F	97.7	Very high	77.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	167.7	175.4	55.4	-92.8	0	0	0	109.9	M56 I79 L89 V114 L118 T134 V135 A137 V170	M56-F116 HydrophobicContact CG-CB 3.98Å; M56-F116 HydrophobicContact CG-CD2 3.61Å; M56-F116 HydrophobicContact CG-CE2 4.37Å; M56-F116 HydrophobicContact CG-CG 3.97Å; M56-F116 HydrophobicContact SD-CB 4.13Å; M56-F116 HydrophobicContact SD-CD1 4.29Å; M56-F116 HydrophobicContact SD-CD2 3.71Å; M56-F116 HydrophobicContact SD-CE2 4.16Å; M56-F116 HydrophobicContact SD-CG 3.78Å; I79-F116 HydrophobicContact CB-CE1 4.12Å; I79-F116 HydrophobicContact CD1-CD1 4.04Å; I79-F116 HydrophobicContact CD1-CE1 3.67Å; I79-F116 HydrophobicContact CD1-CZ 4.22Å; I79-F116 HydrophobicContact CG1-CE1 4.46Å; I79-F116 HydrophobicContact CG2-CE1 4.42Å; L89-F116 HydrophobicContact CD1-CB 4.4Å; L89-F116 HydrophobicContact CD1-CD1 3.82Å; L89-F116 HydrophobicContact CD1-CG 4.48Å; L89-F116 HydrophobicContact CD2-CB 4.49Å; V114-F116 HydrophobicContact CG2-CD1 4.45Å; F116-L118 HydrophobicContact CD2-CD2 4.03Å; F116-L118 HydrophobicContact CD2-CG 4.04Å; F116-L118 HydrophobicContact CE2-CD1 4.05Å; F116-L118 HydrophobicContact CE2-CD2 3.87Å; F116-L118 HydrophobicContact CE2-CG 3.81Å; F116-T134 CarbonylContact O-C 3.59Å; F116-T134 WeakPolarHBondContact O-CA 3.38Å; F116-V135 HydrophobicContact CE2-CB 4.06Å; F116-V135 HydrophobicContact CE2-CG1 4.38Å; F116-V135 HydrophobicContact CZ-CB 4.26Å; F116-V135 HydrophobicContact CZ-CG1 4.14Å; F116-V135 PolarHBondContact N-O 3.03Å; F116-V135 VanDerWaalsContact N-O 3.09Å; F116-V135 PolarHBondContact O-N 3.19Å; F116-A137 HydrophobicContact CE1-CB 3.75Å; F116-A137 HydrophobicContact CZ-CB 4.06Å; F116-V170 HydrophobicContact CE2-CG1 4.17Å; F116-V170 HydrophobicContact CE2-CG2 4.33Å; F116-V170 HydrophobicContact CZ-CG1 3.85Å; F116-V170 HydrophobicContact CZ-CG2 4.14Å
117	A	96.9	Very high	76.4	Confident	3 Å²	3	73 Å²	73	3%	0.025	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.8	176.9	0	0	0	0	0	111.9	M56 R57 W132 R133	M56-A117 CarbonylContact C-O 3.59Å; M56-A117 WeakPolarHBondContact CA-O 3.38Å; R57-A117 PolarHBondContact N-O 2.99Å; R57-A117 PolarHBondContact O-N 3.03Å; A117-W132 HydrophobicContact CB-CB 4.32Å; A117-W132 HydrophobicContact CB-CD2 4.45Å; A117-W132 HydrophobicContact CB-CE3 3.75Å; A117-R133 CarbonylContact C-O 3.56Å; A117-R133 VanDerWaalsContact CA-O 3.28Å; A117-R133 WeakPolarHBondContact CA-O 3.25Å
118	L	97.1	Very high	75.9	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	145.4	176.3	-64	177	0	0	0	111.3	A54 V55 M56 V66 F116 W132 R133 V135 V170 I172 F180 F198	A54-L118 HydrophobicContact CB-CD2 4.34Å; V55-L118 CarbonylContact O-C 3.46Å; V55-L118 WeakPolarHBondContact O-CA 3.18Å; M56-L118 HydrophobicContact CB-CD2 3.86Å; M56-L118 HydrophobicContact CG-CD2 4.04Å; V66-L118 HydrophobicContact CG2-CD2 4.02Å; F116-L118 HydrophobicContact CD2-CD2 4.03Å; F116-L118 HydrophobicContact CD2-CG 4.04Å; F116-L118 HydrophobicContact CE2-CD1 4.05Å; F116-L118 HydrophobicContact CE2-CD2 3.87Å; F116-L118 HydrophobicContact CE2-CG 3.81Å; L118-W132 WeakPolarHBondContact O-CA 3.28Å; L118-R133 PolarHBondContact N-O 3.35Å; L118-R133 PolarHBondContact O-N 3.26Å; L118-V135 HydrophobicContact CD1-CG2 4.2Å; L118-V170 HydrophobicContact CD1-CG1 4.5Å; L118-I172 HydrophobicContact CD1-CD1 3.83Å; L118-I172 HydrophobicContact CD1-CG1 4.38Å; L118-F180 HydrophobicContact CB-CE1 3.78Å; L118-F180 HydrophobicContact CB-CZ 4.01Å; L118-F180 HydrophobicContact CD1-CE1 4.19Å; L118-F180 HydrophobicContact CD1-CZ 3.96Å; L118-F180 HydrophobicContact CG-CZ 4.47Å; L118-F198 HydrophobicContact CB-CE1 3.93Å; L118-F198 HydrophobicContact CB-CZ 3.99Å; L118-F198 HydrophobicContact CD1-CZ 4.06Å
119	S	93.8	Very high	75.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	171.6	172.8	65.6	0	0	0	0	112.1	A54 V55 K130 Q131 W132	A54-S119 WeakPolarHBondContact CA-O 3.33Å; V55-S119 PolarHBondContact N-O 3.07Å; V55-S119 PolarHBondContact O-N 3Å; S119-K130 VanDerWaalsContact OG-CE 3.27Å; S119-K130 WeakPolarHBondContact OG-CE 3.31Å; S119-Q131 WeakPolarHBondContact CB-O 3.35Å; S119-W132 WeakPolarHBondContact OG-CH2 3.48Å; S119-W132 WeakPolarHBondContact OG-CZ3 3.37Å
120	A	91.1	Very high	75.8	Confident	18 Å²	18	71.9 Å²	71.9	15%	0.149	37%	0.373	C	S	.	.			trans	-64.4	157.8	174.7	0	0	0	0	0	112.9	K130	A120-K130 WeakPolarHBondContact O-CE 3.44Å; A120-K130 PolarHBondContact O-NZ 3.2Å
121	L	85.9	Confident	76.3	Confident	61 Å²	61	70.4 Å²	70.4	32%	0.319	37%	0.372	S	S	.	.	S	Bend	trans	-62.3	-65.5	174.6	-63.6	178.1	0	0	0	111.1	R53 V55 V65 S123 K130	R53-L121 HydrophobicContact CB-CD1 3.8Å; R53-L121 HydrophobicContact CB-CD2 4.41Å; R53-L121 HydrophobicContact CB-CG 4.31Å; V55-L121 HydrophobicContact CG2-CD2 3.87Å; V65-L121 HydrophobicContact CB-CD2 4.44Å; V65-L121 HydrophobicContact CG1-CD2 3.77Å; V65-L121 HydrophobicContact CG2-CD2 3.87Å; L121-S123 PolarHBondContact O-N 2.86Å; L121-K130 PolarHBondContact O-NZ 3.43Å
122	D	68.9	Low	76.7	Confident	159 Å²	159	72.4 Å²	72.4	85%	0.85	38%	0.379	S	S	*	.			trans	-99.4	84.1	-173.7	-62.3	-30.1	0	0	0	111
123	S	56.8	Low	77	Confident	36 Å²	36	72.8 Å²	72.8	25%	0.252	38%	0.38	S	S	.	.			trans	-109.8	102.2	156.9	-24.5	0	0	0	0	104.9	L121 E125 K130	L121-S123 PolarHBondContact O-N 2.86Å; S123-E125 PolarHBondContact O-N 3.4Å; S123-K130 WeakPolarHBondContact OG-CE 3.31Å; S123-K130 WeakPolarHBondContact OG-CG 3.29Å
124	G	51.7	Low	77.2	Confident	57 Å²	57	71.9 Å²	71.9	59%	0.588	38%	0.384	S	S	*	.			trans	-49.6	114.8	168.1	0	0	0	0	0	107.2	Q126 R127	G124-Q126 PolarHBondContact O-N 3.35Å; G124-R127 PolarHBondContact O-N 3.42Å
125	E	48	Very low	77.3	Confident	157 Å²	157	71.8 Å²	71.8	73%	0.734	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-13.1	-176	-70.6	178.1	150.6	0	0	112.1	R63 S123	R63-E125 IonicContact NH1-OE1 3.45Å; S123-E125 PolarHBondContact O-N 3.4Å
126	Q	44.5	Very low	77.3	Confident	188 Å²	188	71.4 Å²	71.4	88%	0.879	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.3	-176.1	-65.3	-91.3	-20.7	0	0	116.3	G124	G124-Q126 PolarHBondContact O-N 3.35Å
127	R	45.8	Very low	77.2	Confident	253 Å²	253	71.5 Å²	71.5	96%	0.955	38%	0.383	S	S	*	.	S	Bend	trans	-120.6	6.5	-172.4	-95.1	-176.8	178.4	-179.7	0.1	117.7	G124	G124-R127 PolarHBondContact O-N 3.42Å
128	G	51	Low	77.1	Confident	50 Å²	50	71.9 Å²	71.9	52%	0.515	38%	0.384	S	S	.	.	S	Bend	trans	150.9	139.6	177.6	0	0	0	0	0	109.6	K130	G128-K130 PolarHBondContact O-N 3.33Å
129	A	58.5	Low	76.8	Confident	103 Å²	103	73 Å²	73	85%	0.851	39%	0.388	S	S	*	.			trans	-49.4	125.3	-176.4	0	0	0	0	0	110.8	Q131	A129-Q131 PolarHBondContact O-N 2.87Å; A129-Q131 VanDerWaalsContact O-N 3.11Å
130	K	68.2	Low	76.6	Confident	39 Å²	39	74 Å²	74	17%	0.17	39%	0.394	C	S	.	.			trans	-51.1	119.9	178.1	-166.2	164.5	-157.9	-179.7	0	108.8	S119 A120 L121 S123 G128 W132	S119-K130 VanDerWaalsContact OG-CE 3.27Å; S119-K130 WeakPolarHBondContact OG-CE 3.31Å; A120-K130 WeakPolarHBondContact O-CE 3.44Å; A120-K130 PolarHBondContact O-NZ 3.2Å; L121-K130 PolarHBondContact O-NZ 3.43Å; S123-K130 WeakPolarHBondContact OG-CE 3.31Å; S123-K130 WeakPolarHBondContact OG-CG 3.29Å; G128-K130 PolarHBondContact O-N 3.33Å; K130-W132 HydrophobicContact CD-CZ2 3.84Å; K130-W132 HydrophobicContact CG-CZ2 4.38Å; K130-W132 PolarHBondContact O-N 3.16Å; K130-W132 VanDerWaalsContact O-N 3.09Å
131	Q	86.8	Confident	76.3	Confident	102 Å²	102	76.1 Å²	76.1	48%	0.477	41%	0.407	S	S	.	.			trans	-76.4	103.9	-176	-171.7	177.4	-1.3	0	0	109	S119 A129 R133 L197	S119-Q131 WeakPolarHBondContact CB-O 3.35Å; A129-Q131 PolarHBondContact O-N 2.87Å; A129-Q131 VanDerWaalsContact O-N 3.11Å; Q131-R133 VanDerWaalsContact NE2-CZ 3.27Å; Q131-L197 HydrophobicContact CB-CD1 4.05Å; Q131-L197 VanDerWaalsContact CD-CD1 3.42Å; Q131-L197 HydrophobicContact CG-CD1 3.75Å
132	W	92.5	Very high	76.3	Confident	46 Å²	46	79.2 Å²	79.2	17%	0.174	42%	0.418	C	S	.	.			trans	-91.9	145.7	175.4	-65.1	93.2	0	0	0	110.5	V55 R57 A117 L118 S119 K130	V55-W132 HydrophobicContact CB-CH2 4.46Å; V55-W132 HydrophobicContact CG1-CH2 3.94Å; V55-W132 HydrophobicContact CG1-CZ3 4.45Å; R57-W132 HydrophobicContact CB-CE3 4.1Å; R57-W132 HydrophobicContact CB-CH2 3.55Å; R57-W132 HydrophobicContact CB-CZ2 4.43Å; R57-W132 HydrophobicContact CB-CZ3 3.35Å; R57-W132 HydrophobicContact CG-CH2 4.36Å; R57-W132 HydrophobicContact CG-CZ3 4.49Å; A117-W132 HydrophobicContact CB-CB 4.32Å; A117-W132 HydrophobicContact CB-CD2 4.45Å; A117-W132 HydrophobicContact CB-CE3 3.75Å; L118-W132 WeakPolarHBondContact O-CA 3.28Å; S119-W132 WeakPolarHBondContact OG-CH2 3.48Å; S119-W132 WeakPolarHBondContact OG-CZ3 3.37Å; K130-W132 HydrophobicContact CD-CZ2 3.84Å; K130-W132 HydrophobicContact CG-CZ2 4.38Å; K130-W132 PolarHBondContact O-N 3.16Å; K130-W132 VanDerWaalsContact O-N 3.09Å
133	R	95.6	Very high	77.2	Confident	86 Å²	86	73 Å²	73	33%	0.325	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.6	169.9	-70.2	-66.4	179.5	-102.1	16.6	109.1	A117 L118 Q131 F180 L197	A117-R133 CarbonylContact C-O 3.56Å; A117-R133 VanDerWaalsContact CA-O 3.28Å; A117-R133 WeakPolarHBondContact CA-O 3.25Å; L118-R133 PolarHBondContact N-O 3.35Å; L118-R133 PolarHBondContact O-N 3.26Å; Q131-R133 VanDerWaalsContact NE2-CZ 3.27Å; R133-F180 HydrophobicContact CB-CE1 3.6Å; R133-F180 HydrophobicContact CB-CE2 4.32Å; R133-F180 HydrophobicContact CB-CZ 3.44Å; R133-F180 VanDerWaalsContact CB-CZ 3.44Å; R133-F180 HydrophobicContact CG-CE1 4.1Å; R133-F180 HydrophobicContact CG-CZ 4.28Å; R133-L197 HydrophobicContact CB-CD2 4.23Å; R133-L197 HydrophobicContact CG-CD2 3.67Å
134	T	96.9	Very high	78.5	Confident	67 Å²	67	72.4 Å²	72.4	41%	0.411	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	134.5	176.6	-57.7	0	0	0	0	109.4	M59 Q115 F116	M59-T134 HydrophobicContact CE-CG2 4.08Å; Q115-T134 VanDerWaalsContact CD-CG2 3.47Å; Q115-T134 HydrophobicContact CG-CG2 3.32Å; F116-T134 CarbonylContact O-C 3.59Å; F116-T134 WeakPolarHBondContact O-CA 3.38Å
135	V	97.8	Very high	79.9	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.7	179.7	177	0	0	0	0	108.1	Q115 F116 L118 A137 Y176 F180	Q115-V135 WeakPolarHBondContact CA-O 3.44Å; F116-V135 HydrophobicContact CE2-CB 4.06Å; F116-V135 HydrophobicContact CE2-CG1 4.38Å; F116-V135 HydrophobicContact CZ-CB 4.26Å; F116-V135 HydrophobicContact CZ-CG1 4.14Å; F116-V135 PolarHBondContact N-O 3.03Å; F116-V135 VanDerWaalsContact N-O 3.09Å; F116-V135 PolarHBondContact O-N 3.19Å; L118-V135 HydrophobicContact CD1-CG2 4.2Å; V135-A137 HydrophobicContact CG1-CB 4.44Å; V135-Y176 HydrophobicContact CG1-CD2 3.84Å; V135-Y176 HydrophobicContact CG1-CE2 3.97Å; V135-Y176 HydrophobicContact CG1-CG 4.31Å; V135-Y176 HydrophobicContact CG2-CD1 4.43Å; V135-Y176 HydrophobicContact CG2-CG 4.32Å; V135-F180 HydrophobicContact CG2-CE2 3.6Å; V135-F180 HydrophobicContact CG2-CZ 3.54Å
136	E	97.3	Very high	81.7	Confident	75 Å²	75	68.1 Å²	68.1	35%	0.35	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.8	163.2	-63.9	-171.6	163.6	0	0	109.4	R113 V114 Q115 Y176	R113-E136 HydrophobicContact CG-CB 4.27Å; R113-E136 IonicContact NE-OE2 3.07Å; V114-E136 CarbonylContact O-C 3.59Å; V114-E136 VanDerWaalsContact O-CA 3.29Å; V114-E136 WeakPolarHBondContact O-CA 3.25Å; Q115-E136 HydrophobicContact CB-CG 4.33Å; Q115-E136 HydrophobicContact CG-CG 3.94Å; Q115-E136 PolarHBondContact NE2-OE1 3.24Å; E136-Y176 WeakPolarHBondContact CB-OH 3.38Å; E136-Y176 PolarHBondContact N-OH 3.26Å; E136-Y176 VanDerWaalsContact N-OH 3.13Å; E136-Y176 WeakPolarHBondContact O-CE2 3.37Å
137	A	96.7	Very high	83.5	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.017	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	147.7	-176	0	0	0	0	0	111.9	S77 I79 R113 V114 F116 V135	S77-A137 VanDerWaalsContact O-CA 3.28Å; S77-A137 WeakPolarHBondContact O-CA 3.11Å; I79-A137 HydrophobicContact CB-CB 4.23Å; I79-A137 HydrophobicContact CG2-CB 4.08Å; R113-A137 WeakPolarHBondContact CA-O 3.29Å; V114-A137 PolarHBondContact N-O 3.29Å; V114-A137 PolarHBondContact O-N 3.16Å; F116-A137 HydrophobicContact CE1-CB 3.75Å; F116-A137 HydrophobicContact CZ-CB 4.06Å; V135-A137 HydrophobicContact CG1-CB 4.44Å
138	L	93.7	Very high	85	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.052	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	144.2	174.4	-63.4	169.5	0	0	0	110.8	R76 S77 F78 I79 V96 T111 R112 R113 V222	R76-L138 HydrophobicContact CG-CD1 4.48Å; S77-L138 PolarHBondContact O-N 3.47Å; F78-L138 VanDerWaalsContact CA-O 3.27Å; F78-L138 WeakPolarHBondContact CA-O 3.36Å; F78-L138 HydrophobicContact CD1-CB 3.72Å; F78-L138 HydrophobicContact CE1-CB 3.91Å; F78-L138 HydrophobicContact CE1-CD1 4.01Å; I79-L138 PolarHBondContact N-O 3.28Å; V96-L138 HydrophobicContact CB-CD1 4.47Å; V96-L138 HydrophobicContact CG1-CD1 3.93Å; V96-L138 HydrophobicContact CG1-CD2 4.19Å; V96-L138 HydrophobicContact CG2-CD1 4.41Å; T111-L138 HydrophobicContact CG2-CB 4.17Å; T111-L138 HydrophobicContact CG2-CD2 3.87Å; T111-L138 HydrophobicContact CG2-CG 4.49Å; R112-L138 WeakPolarHBondContact O-CA 3.35Å; R113-L138 HydrophobicContact CB-CD2 4.08Å; L138-V222 HydrophobicContact CD1-CG1 4.03Å
139	W	91.7	Very high	86.3	Confident	23 Å²	23	52.6 Å²	52.6	9%	0.087	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	137.7	176.6	-68.1	15.9	0	0	0	111.8	I79 E81 A84 N85 L89 T111 R112 V114	I79-W139 HydrophobicContact CG2-CG 4.46Å; I79-W139 WeakPolarHBondContact O-CA 3.19Å; E81-W139 HydrophobicContact CG-CB 3.96Å; E81-W139 HydrophobicContact CG-CD2 4.48Å; E81-W139 HydrophobicContact CG-CE3 3.98Å; A84-W139 HydrophobicContact CB-CD2 3.97Å; A84-W139 HydrophobicContact CB-CG 4.37Å; A84-W139 HydrophobicContact CB-CH2 4.2Å; A84-W139 HydrophobicContact CB-CZ2 3.46Å; A84-W139 VanDerWaalsContact CB-CZ2 3.46Å; N85-W139 WeakPolarHBondContact OD1-CH2 3.39Å; N85-W139 WeakPolarHBondContact OD1-CZ3 3.4Å; L89-W139 VanDerWaalsContact O-CZ2 3.23Å; L89-W139 WeakPolarHBondContact O-CZ2 3.2Å; T111-W139 WeakPolarHBondContact OG1-CA 3.38Å; T111-W139 VanDerWaalsContact OG1-CB 3.25Å; T111-W139 WeakPolarHBondContact OG1-CB 3.29Å; T111-W139 PolarHBondContact OG1-N 3.31Å; T111-W139 PolarHBondContact OG1-O 3.36Å; R112-W139 HydrophobicContact CB-CD2 3.92Å; R112-W139 HydrophobicContact CB-CE3 4.44Å; R112-W139 HydrophobicContact CB-CG 4.07Å; R112-W139 HydrophobicContact CG-CD2 4.47Å; R112-W139 PolarHBondContact O-N 3.44Å; V114-W139 HydrophobicContact CG1-CZ2 4.08Å; V114-W139 VanDerWaalsContact CG2-NE1 3.26Å
140	L	88.9	Confident	87.1	Confident	21 Å²	21	48.4 Å²	48.4	11%	0.11	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	139.3	168	-74.4	179.5	0	0	0	110.4	F78 I79 T80 E81 I98 K142	F78-L140 HydrophobicContact CB-CD1 3.97Å; F78-L140 HydrophobicContact CB-CG 4.42Å; F78-L140 HydrophobicContact CD1-CD1 3.34Å; F78-L140 HydrophobicContact CD1-CG 3.62Å; F78-L140 HydrophobicContact CD2-CD1 4.26Å; F78-L140 HydrophobicContact CE1-CD1 3.79Å; F78-L140 HydrophobicContact CE1-CG 4.17Å; F78-L140 HydrophobicContact CG-CD1 3.6Å; F78-L140 HydrophobicContact CG-CG 4.23Å; F78-L140 HydrophobicContact CZ-CD1 4.39Å; I79-L140 PolarHBondContact O-N 3.26Å; T80-L140 CarbonylContact C-O 3.37Å; T80-L140 WeakPolarHBondContact CA-O 3.37Å; E81-L140 PolarHBondContact N-O 2.92Å; I98-L140 HydrophobicContact CD1-CD1 4.39Å; I98-L140 HydrophobicContact CD1-CD2 3.6Å; I98-L140 HydrophobicContact CD1-CG 4.43Å; L140-K142 PolarHBondContact O-N 3.44Å
141	S	86	Confident	87.2	Confident	63 Å²	63	48.6 Å²	48.6	44%	0.441	26%	0.258	S	S	.	.	S	Bend	trans	-60.2	-35.2	174.9	54.9	0	0	0	0	111.2	E81	E81-S141 WeakPolarHBondContact OE2-CA 3.25Å; E81-S141 WeakPolarHBondContact OE2-CB 3.47Å
142	K	84.9	Confident	86.2	Confident	126 Å²	126	51.2 Å²	51.2	55%	0.548	28%	0.275	S	S	.	.			trans	-151.6	130.8	177.7	-174.8	176.6	-179.3	178.5	0	110.6	L140 C144	L140-K142 PolarHBondContact O-N 3.44Å; K142-C144 VanDerWaalsContact CE-O 3.22Å; K142-C144 WeakPolarHBondContact CE-O 3.23Å; K142-C144 WeakPolarHBondContact CG-O 3.42Å
143	I	87.3	Confident	84.8	Confident	28 Å²	28	50 Å²	50	14%	0.144	27%	0.272	C	S	.	.	S	Bend	trans	-81.6	-54.6	174.3	-66.5	170.1	0	0	0	110.2	F78 T80 I168 L171	F78-I143 HydrophobicContact CB-CD1 4.46Å; F78-I143 HydrophobicContact CB-CG1 4.39Å; T80-I143 HydrophobicContact CG2-CD1 3.86Å; T80-I143 HydrophobicContact CG2-CG1 4.01Å; I143-I168 HydrophobicContact CD1-CG2 4.05Å; I143-I168 HydrophobicContact CG2-CG2 4.12Å; I143-L171 HydrophobicContact CD1-CB 4.1Å; I143-L171 HydrophobicContact CG2-CB 3.92Å; I143-L171 HydrophobicContact CG2-CD1 3.79Å
144	C	84.3	Confident	83.2	Confident	24 Å²	24	54.7 Å²	54.7	16%	0.162	30%	0.297	C	S	.	.	S	Bend	trans	-153.7	175.1	176.7	64.5	0	0	0	0	110.9	K142 L218	K142-C144 VanDerWaalsContact CE-O 3.22Å; K142-C144 WeakPolarHBondContact CE-O 3.23Å; K142-C144 WeakPolarHBondContact CG-O 3.42Å; C144-L218 HydrophobicContact CB-CD2 4.23Å
145	S	81.7	Confident	81.6	Confident	56 Å²	56	62 Å²	62	39%	0.392	32%	0.318	S	S	.	.	S	Bend	trans	-67.6	152.4	168.2	54.8	0	0	0	0	110.6	I147	S145-I147 PolarHBondContact O-N 2.77Å
146	P	84.9	Confident	79.8	Confident	69 Å²	69	69 Å²	69	45%	0.448	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-47.7	134.9	177.1	-29.6	35.8	0	0	0	112.5	S166	P146-S166 CarbonylContact C-O 3.42Å; P146-S166 WeakPolarHBondContact CA-O 3.35Å
147	I	82.5	Confident	78.2	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.026	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-79.8	134.9	176.8	56.6	168.3	0	0	0	108.9	L49 T51 S145 R163 C165 S166 I168	L49-I147 HydrophobicContact CD1-CG2 4.4Å; T51-I147 HydrophobicContact CG2-CD1 3.65Å; S145-I147 PolarHBondContact O-N 2.77Å; I147-R163 VanDerWaalsContact CD1-CZ 3.44Å; I147-C165 CarbonylContact O-C 3.59Å; I147-C165 VanDerWaalsContact O-CA 3.28Å; I147-C165 WeakPolarHBondContact O-CA 3.39Å; I147-C165 PolarHBondContact O-SG 3.25Å; I147-S166 WeakPolarHBondContact CG1-O 3.46Å; I147-S166 PolarHBondContact N-O 2.84Å; I147-S166 PolarHBondContact O-N 2.92Å; I147-I168 HydrophobicContact CD1-CD1 3.69Å; I147-I168 HydrophobicContact CG1-CD1 4.22Å; I147-I168 HydrophobicContact CG2-CD1 4.37Å; I147-I168 HydrophobicContact CG2-CG1 4.19Å
148	Q	77.9	Confident	76.4	Confident	114 Å²	114	74.1 Å²	74.1	53%	0.533	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-66.2	154.6	-179.9	-70.9	179.1	-30.4	0	0	111.3	R163	Q148-R163 PolarHBondContact O-NH2 3.48Å
149	A	79.3	Confident	74.6	Confident	46 Å²	46	80.9 Å²	80.9	38%	0.38	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-53.6	144.3	172.3	0	0	0	0	0	111.8	R46 R163	R46-A149 PolarHBondContact NH1-O 3.23Å; R46-A149 PolarHBondContact NH2-O 3.47Å; A149-R163 CarbonylContact C-O 3.55Å; A149-R163 VanDerWaalsContact CA-O 3.28Å; A149-R163 WeakPolarHBondContact CA-O 3.29Å; A149-R163 WeakPolarHBondContact CB-O 3.32Å
150	N	75.1	Confident	72.9	Confident	15 Å²	15	81.9 Å²	81.9	8%	0.08	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-67.7	140.3	173.1	-76	-28.7	0	0	0	110	Y161 R163	N150-Y161 HydrophobicContact CB-CD1 3.59Å; N150-Y161 HydrophobicContact CB-CE1 3.4Å; N150-Y161 VanDerWaalsContact CB-CE1 3.4Å; N150-Y161 WeakPolarHBondContact ND2-CD1 3.49Å; N150-Y161 WeakPolarHBondContact ND2-CE1 3.31Å; N150-Y161 WeakPolarHBondContact ND2-CE2 3.48Å; N150-Y161 PolarHBondContact ND2-OH 2.99Å; N150-Y161 VanDerWaalsContact ND2-OH 3.09Å; N150-Y161 WeakPolarHBondContact OD1-CE1 3.33Å; N150-Y161 PolarHBondContact OD1-OH 3.1Å; N150-Y161 VanDerWaalsContact OD1-OH 3.1Å; N150-R163 HydrophobicContact CB-CB 4.35Å; N150-R163 PolarHBondContact N-O 3.32Å; N150-R163 WeakPolarHBondContact ND2-CB 3.4Å; N150-R163 PolarHBondContact ND2-NH1 3.17Å; N150-R163 PolarHBondContact OD1-NH1 2.9Å; N150-R163 PolarHBondContact OD1-NH2 2.85Å
151	P	69.3	Low	71.5	Confident	42 Å²	42	81.8 Å²	81.8	27%	0.273	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-66.9	151.3	173.3	30.4	-33.1	0	0	0	110.2	L153 M206	P151-L153 PolarHBondContact O-N 3.27Å; P151-M206 HydrophobicContact CG-CE 3.95Å
152	L	65.4	Low	70.5	Confident	158 Å²	158	84 Å²	84	83%	0.827	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-63.1	117.2	172.1	-66.2	174.6	0	0	0	109.4	Q154	L152-Q154 PolarHBondContact O-N 3.29Å
153	L	64.6	Low	70.1	Confident	21 Å²	21	79.7 Å²	79.7	11%	0.11	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-76.5	121.7	177.2	-67.7	170.5	0	0	0	109.2	P151 R155 W157 K158 Y161 M206	P151-L153 PolarHBondContact O-N 3.27Å; L153-R155 VanDerWaalsContact C-N 3.33Å; L153-R155 PolarHBondContact O-N 2.94Å; L153-W157 HydrophobicContact CB-CB 4.13Å; L153-W157 HydrophobicContact CD1-CB 3.34Å; L153-W157 HydrophobicContact CD1-CG 4.2Å; L153-W157 HydrophobicContact CG-CB 4.28Å; L153-K158 WeakPolarHBondContact O-CG 3.16Å; L153-Y161 HydrophobicContact CD1-CD1 3.52Å; L153-Y161 HydrophobicContact CD1-CE1 4.32Å; L153-Y161 HydrophobicContact CD1-CG 3.82Å; L153-Y161 HydrophobicContact CG-CD1 4.23Å; L153-M206 HydrophobicContact CD2-CE 3.54Å; L153-M206 HydrophobicContact CD2-SD 4.24Å
154	Q	60.6	Low	69.8	Low	183 Å²	183	85.9 Å²	85.9	86%	0.855	42%	0.423	S	S	*	.			trans	-70.8	-17	-168.1	-78.8	-167.3	-14.6	0	0	115.7	L152 K158	L152-Q154 PolarHBondContact O-N 3.29Å; Q154-K158 VanDerWaalsContact C-CE 3.48Å; Q154-K158 WeakPolarHBondContact O-CE 3.34Å; Q154-K158 PolarHBondContact O-NZ 3.42Å
155	R	63.6	Low	69.8	Low	222 Å²	222	88.5 Å²	88.5	84%	0.838	44%	0.441	S	S	*	.	S	Bend	trans	-142.5	-82.2	-172.7	-133.1	172.5	75.2	124.8	-0.1	115	L153	L153-R155 VanDerWaalsContact C-N 3.33Å; L153-R155 PolarHBondContact O-N 2.94Å
156	R	61	Low	70	Confident	147 Å²	147	87.1 Å²	87.1	56%	0.555	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-28.3	-160.8	-161.1	171.6	-178.8	174.5	-5.1	114.2	H159 H187	R156-H159 PolarHBondContact O-CE1 3.17Å; R156-H159 VanDerWaalsContact O-CE1 3.3Å; R156-H159 PolarHBondContact O-ND1 3.47Å; R156-H187 PolarHBondContact NH1-CD2 2.99Å; R156-H187 VanDerWaalsContact NH1-CD2 3.32Å; R156-H187 PolarHBondContact NH1-NE2 3.49Å
157	W	63	Low	70.3	Confident	42 Å²	42	87.5 Å²	87.5	16%	0.159	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	14.6	-168.4	-57.4	112.9	0	0	0	113.7	L153 H159 V160 A193 V202	L153-W157 HydrophobicContact CB-CB 4.13Å; L153-W157 HydrophobicContact CD1-CB 3.34Å; L153-W157 HydrophobicContact CD1-CG 4.2Å; L153-W157 HydrophobicContact CG-CB 4.28Å; W157-H159 PolarHBondContact O-N 3.18Å; W157-H159 VanDerWaalsContact O-N 3.16Å; W157-V160 HydrophobicContact CE3-CG2 4.17Å; W157-V160 PolarHBondContact O-N 3.48Å; W157-V160 VanDerWaalsContact O-N 3.08Å; W157-A193 HydrophobicContact CH2-CB 3.48Å; W157-A193 VanDerWaalsContact CH2-CB 3.48Å; W157-A193 HydrophobicContact CZ2-CB 3.99Å; W157-A193 HydrophobicContact CZ3-CB 3.94Å; W157-V202 HydrophobicContact CD2-CG2 4.42Å; W157-V202 HydrophobicContact CE3-CG2 4.43Å
158	K	58.8	Low	70.8	Confident	141 Å²	141	87.4 Å²	87.4	61%	0.613	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-52.8	-37.8	-178.9	-77.7	-174.8	-178.4	-179.1	0	113.1	L153 Q154 V160	L153-K158 WeakPolarHBondContact O-CG 3.16Å; Q154-K158 VanDerWaalsContact C-CE 3.48Å; Q154-K158 WeakPolarHBondContact O-CE 3.34Å; Q154-K158 PolarHBondContact O-NZ 3.42Å; K158-V160 VanDerWaalsContact C-N 3.3Å; K158-V160 PolarHBondContact O-N 3.09Å
159	H	56.6	Low	71.7	Confident	153 Å²	153	83 Å²	83	71%	0.708	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-75	-14	-176.3	61.7	-81.5	0	0	0	114.1	R156 W157	R156-H159 PolarHBondContact O-CE1 3.17Å; R156-H159 VanDerWaalsContact O-CE1 3.3Å; R156-H159 PolarHBondContact O-ND1 3.47Å; W157-H159 PolarHBondContact O-N 3.18Å; W157-H159 VanDerWaalsContact O-N 3.16Å
160	V	56.4	Low	72.6	Confident	44 Å²	44	80.9 Å²	80.9	27%	0.267	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-98.3	-16.8	-171.7	-172.9	0	0	0	0	112.7	W157 K158 W200 V202	W157-V160 HydrophobicContact CE3-CG2 4.17Å; W157-V160 PolarHBondContact O-N 3.48Å; W157-V160 VanDerWaalsContact O-N 3.08Å; K158-V160 VanDerWaalsContact C-N 3.3Å; K158-V160 PolarHBondContact O-N 3.09Å; V160-W200 WeakPolarHBondContact CG1-O 3.32Å; V160-V202 HydrophobicContact CG1-CG2 4.42Å
161	Y	58.8	Low	73.6	Confident	18 Å²	18	80.6 Å²	80.6	7%	0.071	39%	0.386	C	S	.	.			trans	-145.3	11.9	-140.3	-143	-112.8	0	0	0	123.3	L48 N150 L153 R163 V202	L48-Y161 HydrophobicContact CD1-CE1 3.77Å; N150-Y161 HydrophobicContact CB-CD1 3.59Å; N150-Y161 HydrophobicContact CB-CE1 3.4Å; N150-Y161 VanDerWaalsContact CB-CE1 3.4Å; N150-Y161 WeakPolarHBondContact ND2-CD1 3.49Å; N150-Y161 WeakPolarHBondContact ND2-CE1 3.31Å; N150-Y161 WeakPolarHBondContact ND2-CE2 3.48Å; N150-Y161 PolarHBondContact ND2-OH 2.99Å; N150-Y161 VanDerWaalsContact ND2-OH 3.09Å; N150-Y161 WeakPolarHBondContact OD1-CE1 3.33Å; N150-Y161 PolarHBondContact OD1-OH 3.1Å; N150-Y161 VanDerWaalsContact OD1-OH 3.1Å; L153-Y161 HydrophobicContact CD1-CD1 3.52Å; L153-Y161 HydrophobicContact CD1-CE1 4.32Å; L153-Y161 HydrophobicContact CD1-CG 3.82Å; L153-Y161 HydrophobicContact CG-CD1 4.23Å; Y161-R163 VanDerWaalsContact C-N 3.33Å; Y161-R163 PolarHBondContact O-N 3.04Å; Y161-V202 HydrophobicContact CD2-CB 3.91Å; Y161-V202 HydrophobicContact CD2-CG2 3.98Å; Y161-V202 HydrophobicContact CE1-CB 4.33Å; Y161-V202 HydrophobicContact CE2-CB 3.59Å; Y161-V202 HydrophobicContact CE2-CG2 4.17Å; Y161-V202 HydrophobicContact CG-CB 4.47Å; Y161-V202 HydrophobicContact CG-CG2 4.46Å; Y161-V202 PolarHBondContact OH-O 2.57Å
162	P	64.2	Low	74.9	Confident	110 Å²	110	78.6 Å²	78.6	71%	0.714	37%	0.373	S	S	*	.			trans	-73.5	92.6	165.4	28.5	-27.8	0	0	0	109.5
163	R	77.8	Confident	76.3	Confident	35 Å²	35	71 Å²	71	13%	0.132	33%	0.333	C	S	.	.			trans	-98.3	128.5	164	-169.2	-159.8	62.7	-124.9	-10.4	108.5	T51 M67 I147 Q148 A149 N150 Y161	T51-R163 PolarHBondContact OG1-NH1 3.4Å; M67-R163 HydrophobicContact CE-CG 4.02Å; I147-R163 VanDerWaalsContact CD1-CZ 3.44Å; Q148-R163 PolarHBondContact O-NH2 3.48Å; A149-R163 CarbonylContact C-O 3.55Å; A149-R163 VanDerWaalsContact CA-O 3.28Å; A149-R163 WeakPolarHBondContact CA-O 3.29Å; A149-R163 WeakPolarHBondContact CB-O 3.32Å; N150-R163 HydrophobicContact CB-CB 4.35Å; N150-R163 PolarHBondContact N-O 3.32Å; N150-R163 WeakPolarHBondContact ND2-CB 3.4Å; N150-R163 PolarHBondContact ND2-NH1 3.17Å; N150-R163 PolarHBondContact OD1-NH1 2.9Å; N150-R163 PolarHBondContact OD1-NH2 2.85Å; Y161-R163 VanDerWaalsContact C-N 3.33Å; Y161-R163 PolarHBondContact O-N 3.04Å
164	E	79.6	Confident	77.7	Confident	158 Å²	158	73.5 Å²	73.5	74%	0.738	35%	0.346	S	S	*	.			trans	-68.7	177.2	171.2	-61.9	-176.7	170.5	0	0	111.9	S166	E164-S166 PolarHBondContact O-N 2.65Å; E164-S166 PolarHBondContact O-OG 2.85Å
165	C	84	Confident	79.4	Confident	79 Å²	79	67.4 Å²	67.4	53%	0.534	32%	0.319	S	S	.	.	S	Bend	trans	-60.9	134.2	165.5	-170.1	0	0	0	0	108.2	I147	I147-C165 CarbonylContact O-C 3.59Å; I147-C165 VanDerWaalsContact O-CA 3.28Å; I147-C165 WeakPolarHBondContact O-CA 3.39Å; I147-C165 PolarHBondContact O-SG 3.25Å
166	S	85.8	Confident	81	Confident	27 Å²	27	59 Å²	59	19%	0.189	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-145.3	148.3	-174.1	-55.8	0	0	0	0	111.8	P146 I147 E164	P146-S166 CarbonylContact C-O 3.42Å; P146-S166 WeakPolarHBondContact CA-O 3.35Å; I147-S166 WeakPolarHBondContact CG1-O 3.46Å; I147-S166 PolarHBondContact N-O 2.84Å; I147-S166 PolarHBondContact O-N 2.92Å; E164-S166 PolarHBondContact O-N 2.65Å; E164-S166 PolarHBondContact O-OG 2.85Å
167	K	92.2	Very high	82.7	Confident	77 Å²	77	53.1 Å²	53.1	34%	0.335	27%	0.266	S	S	.	.			trans	-77.2	148.5	163.8	-174.4	173.6	173.7	175.4	0	108.8	M67 E82	M67-K167 VanDerWaalsContact CB-O 3.31Å; M67-K167 WeakPolarHBondContact CB-O 3.36Å; E82-K167 IonicContact OE2-NZ 3.77Å; E82-K167 PolarHBondContact OE2-NZ 3.12Å
168	I	92.9	Very high	84.2	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.015	29%	0.291	C	S	.	.			trans	-90.8	124.9	168.7	-63.4	-56.4	0	0	0	107.7	T51 M67 L69 T80 I143 I147 V170	T51-I168 HydrophobicContact CG2-CD1 4.19Å; M67-I168 HydrophobicContact CG-CD1 3.69Å; L69-I168 HydrophobicContact CB-CD1 4.02Å; L69-I168 HydrophobicContact CB-CG1 4.19Å; L69-I168 HydrophobicContact CB-CG2 3.73Å; T80-I168 WeakPolarHBondContact CG2-O 3.31Å; I143-I168 HydrophobicContact CD1-CG2 4.05Å; I143-I168 HydrophobicContact CG2-CG2 4.12Å; I147-I168 HydrophobicContact CD1-CD1 3.69Å; I147-I168 HydrophobicContact CG1-CD1 4.22Å; I147-I168 HydrophobicContact CG2-CD1 4.37Å; I147-I168 HydrophobicContact CG2-CG1 4.19Å; I168-V170 WeakPolarHBondContact CG2-O 3.37Å
169	D	96.6	Very high	86	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.123	28%	0.282	C	S	.	.			trans	-94	-35.2	179.3	-52.9	-59.5	0	0	0	111.8	V66 M67 T80 L83	V66-D169 WeakPolarHBondContact CA-OD2 3.39Å; V66-D169 HydrophobicContact CB-CB 4.16Å; V66-D169 HydrophobicContact CG1-CB 4.47Å; M67-D169 PolarHBondContact N-OD2 2.92Å; M67-D169 PolarHBondContact O-N 3.38Å; T80-D169 PolarHBondContact N-O 3.09Å; T80-D169 PolarHBondContact OG1-O 3.48Å; L83-D169 HydrophobicContact CD2-CB 3.63Å
170	V	97.8	Very high	87.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.7	-176.9	-179.2	0	0	0	0	110.3	M67 C68 L69 F78 I79 L83 F116 L118 I168 I172	M67-V170 PolarHBondContact O-N 3.44Å; C68-V170 CarbonylContact C-O 3.53Å; C68-V170 VanDerWaalsContact CA-O 3.26Å; C68-V170 WeakPolarHBondContact CA-O 3.4Å; L69-V170 PolarHBondContact N-O 2.67Å; F78-V170 CarbonylContact O-C 3.53Å; F78-V170 WeakPolarHBondContact O-CA 3.5Å; I79-V170 HydrophobicContact CD1-CG2 4.43Å; I79-V170 HydrophobicContact CG1-CG2 4.27Å; L83-V170 HydrophobicContact CD2-CG2 3.94Å; F116-V170 HydrophobicContact CE2-CG1 4.17Å; F116-V170 HydrophobicContact CE2-CG2 4.33Å; F116-V170 HydrophobicContact CZ-CG1 3.85Å; F116-V170 HydrophobicContact CZ-CG2 4.14Å; L118-V170 HydrophobicContact CD1-CG1 4.5Å; I168-V170 WeakPolarHBondContact CG2-O 3.37Å; V170-I172 HydrophobicContact CG1-CG1 4.24Å
171	L	96.9	Very high	89.5	Confident	9 Å²	9	48.1 Å²	48.1	5%	0.047	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.8	167.4	-175.9	151.8	0	0	0	108.3	L69 D71 S74 R76 S77 F78 I143	L69-L171 HydrophobicContact CD2-CD1 4.12Å; L69-L171 CarbonylContact O-C 3.55Å; L69-L171 WeakPolarHBondContact O-CA 3.32Å; D71-L171 HydrophobicContact CB-CD1 4.03Å; D71-L171 HydrophobicContact CB-CD2 4.08Å; D71-L171 HydrophobicContact CB-CG 4.01Å; S74-L171 VanDerWaalsContact CB-CD2 3.46Å; R76-L171 WeakPolarHBondContact O-CD2 3.16Å; S77-L171 CarbonylContact C-O 3.59Å; S77-L171 WeakPolarHBondContact CA-O 3.49Å; S77-L171 WeakPolarHBondContact CB-O 3.35Å; F78-L171 HydrophobicContact CB-CB 4.26Å; F78-L171 HydrophobicContact CD2-CB 4.45Å; F78-L171 HydrophobicContact CD2-CD2 3.9Å; F78-L171 PolarHBondContact N-O 3.18Å; F78-L171 PolarHBondContact O-N 3.15Å; I143-L171 HydrophobicContact CD1-CB 4.1Å; I143-L171 HydrophobicContact CG2-CB 3.92Å; I143-L171 HydrophobicContact CG2-CD1 3.79Å
172	I	97.3	Very high	91	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	106.2	176	-57.6	174.9	0	0	0	106.9	C68 L69 L70 D71 S77 L118 V170 F180 F198	C68-I172 HydrophobicContact CB-CD1 4.14Å; L69-I172 PolarHBondContact O-N 2.85Å; L70-I172 HydrophobicContact CG-CB 4.5Å; L70-I172 HydrophobicContact CG-CD1 4.45Å; D71-I172 PolarHBondContact N-O 2.63Å; S77-I172 WeakPolarHBondContact OG-CA 3.42Å; L118-I172 HydrophobicContact CD1-CD1 3.83Å; L118-I172 HydrophobicContact CD1-CG1 4.38Å; V170-I172 HydrophobicContact CG1-CG1 4.24Å; I172-F180 HydrophobicContact CD1-CD1 4.49Å; I172-F180 HydrophobicContact CD1-CD2 3.92Å; I172-F180 HydrophobicContact CD1-CE2 4.14Å; I172-F180 HydrophobicContact CD1-CG 4.1Å; I172-F180 HydrophobicContact CG2-CD2 3.69Å; I172-F180 HydrophobicContact CG2-CE2 4.12Å; I172-F198 HydrophobicContact CD1-CE2 3.99Å; I172-F198 HydrophobicContact CD1-CZ 4.17Å
173	G	94.8	Very high	92.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.			trans	-80.3	179.7	177.6	0	0	0	0	0	112.5	S74 R76 S77 D175 Y176 Y177	S74-G173 CarbonylContact O-C 3.59Å; S74-G173 WeakPolarHBondContact O-CA 3.49Å; R76-G173 WeakPolarHBondContact O-CA 3.34Å; S77-G173 PolarHBondContact OG-N 2.9Å; G173-D175 WeakPolarHBondContact CA-OD1 3.36Å; G173-D175 PolarHBondContact O-N 3.41Å; G173-D175 VanDerWaalsContact O-N 3.16Å; G173-Y176 CarbonylContact O-C 3.57Å; G173-Y176 PolarHBondContact O-N 3.36Å; G173-Y177 WeakPolarHBondContact O-CA 3.39Å; G173-Y177 VanDerWaalsContact O-CB 3.26Å; G173-Y177 WeakPolarHBondContact O-CB 3.41Å; G173-Y177 PolarHBondContact O-N 3.01Å
174	L	92.9	Very high	92.8	Very high	73 Å²	73	49.1 Å²	49.1	38%	0.382	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24	176.4	-79	179.1	0	0	0	114.3	A72 S74 Y176 Y177 Y178	A72-L174 HydrophobicContact CB-CD2 3.8Å; A72-L174 HydrophobicContact CB-CG 4.42Å; A72-L174 WeakPolarHBondContact O-CD1 3.47Å; A72-L174 VanDerWaalsContact O-CG 3.28Å; A72-L174 WeakPolarHBondContact O-CG 3.38Å; S74-L174 WeakPolarHBondContact O-CB 3.26Å; S74-L174 PolarHBondContact O-N 3.1Å; L174-Y176 PolarHBondContact O-N 2.87Å; L174-Y177 HydrophobicContact CD2-CG 4.45Å; L174-Y178 HydrophobicContact CD2-CE2 4.23Å
175	D	95.6	Very high	93.1	Very high	54 Å²	54	43.8 Å²	43.8	29%	0.289	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.1	173.9	54.5	-13.4	0	0	0	113	R76 S77 G173	R76-D175 VanDerWaalsContact CA-OD2 3.27Å; R76-D175 WeakPolarHBondContact CA-OD2 2.99Å; S77-D175 PolarHBondContact N-OD1 2.8Å; S77-D175 PolarHBondContact N-OD2 3.21Å; S77-D175 PolarHBondContact OG-OD1 2.93Å; G173-D175 WeakPolarHBondContact CA-OD1 3.36Å; G173-D175 PolarHBondContact O-N 3.41Å; G173-D175 VanDerWaalsContact O-N 3.16Å
176	Y	97.6	Very high	93.1	Very high	47 Å²	47	48.2 Å²	48.2	18%	0.184	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-1.8	176.1	-63.6	-80.9	0	0	0	113.9	S77 V135 E136 G173 L174 Y178 D179 F180	S77-Y176 WeakPolarHBondContact OG-CD2 3.18Å; V135-Y176 HydrophobicContact CG1-CD2 3.84Å; V135-Y176 HydrophobicContact CG1-CE2 3.97Å; V135-Y176 HydrophobicContact CG1-CG 4.31Å; V135-Y176 HydrophobicContact CG2-CD1 4.43Å; V135-Y176 HydrophobicContact CG2-CG 4.32Å; E136-Y176 WeakPolarHBondContact CB-OH 3.38Å; E136-Y176 PolarHBondContact N-OH 3.26Å; E136-Y176 VanDerWaalsContact N-OH 3.13Å; E136-Y176 WeakPolarHBondContact O-CE2 3.37Å; G173-Y176 CarbonylContact O-C 3.57Å; G173-Y176 PolarHBondContact O-N 3.36Å; L174-Y176 PolarHBondContact O-N 2.87Å; Y176-Y178 VanDerWaalsContact C-N 3.26Å; Y176-Y178 PolarHBondContact O-N 2.97Å; Y176-Y178 VanDerWaalsContact O-N 3.12Å; Y176-D179 VanDerWaalsContact O-CB 3.31Å; Y176-D179 WeakPolarHBondContact O-CB 3.19Å; Y176-D179 PolarHBondContact O-N 3.19Å; Y176-F180 VanDerWaalsContact O-CD2 3.28Å; Y176-F180 WeakPolarHBondContact O-CD2 3.4Å
177	Y	96.2	Very high	92.8	Very high	22 Å²	22	50.6 Å²	50.6	9%	0.086	27%	0.265	C	S	.	.	H	α-helix	trans	-53.3	-42	-170.9	-179.2	-84	0	0	0	112.8	Q50 L70 A72 G173 L174 D179 F180 S181	Q50-Y177 VanDerWaalsContact CD-OH 3.3Å; Q50-Y177 PolarHBondContact NE2-OH 2.93Å; Q50-Y177 PolarHBondContact OE1-OH 3.24Å; L70-Y177 HydrophobicContact CB-CD2 4Å; L70-Y177 HydrophobicContact CB-CE2 3.81Å; A72-Y177 HydrophobicContact CB-CD2 4.19Å; A72-Y177 HydrophobicContact CB-CE2 3.97Å; G173-Y177 WeakPolarHBondContact O-CA 3.39Å; G173-Y177 VanDerWaalsContact O-CB 3.26Å; G173-Y177 WeakPolarHBondContact O-CB 3.41Å; G173-Y177 PolarHBondContact O-N 3.01Å; L174-Y177 HydrophobicContact CD2-CG 4.45Å; Y177-D179 VanDerWaalsContact C-N 3.32Å; Y177-F180 PolarHBondContact O-N 3.37Å; Y177-S181 WeakPolarHBondContact CD1-OG 3.38Å; Y177-S181 WeakPolarHBondContact CE1-OG 3.41Å; Y177-S181 WeakPolarHBondContact O-CB 3.23Å; Y177-S181 PolarHBondContact O-N 3Å; Y177-S181 PolarHBondContact O-OG 3.12Å
178	Y	95.8	Very high	92.2	Very high	172 Å²	172	51.2 Å²	51.2	68%	0.675	29%	0.285	S	S	*	.	H	α-helix	trans	-80.6	-9.4	-178.8	-64.3	-67	0	0	0	114.2	L174 Y176 F180	L174-Y178 HydrophobicContact CD2-CE2 4.23Å; Y176-Y178 VanDerWaalsContact C-N 3.26Å; Y176-Y178 PolarHBondContact O-N 2.97Å; Y176-Y178 VanDerWaalsContact O-N 3.12Å; Y178-F180 VanDerWaalsContact C-N 3.28Å
179	D	95.4	Very high	91.4	Very high	82 Å²	82	54.1 Å²	54.1	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-76.3	-23.3	169.8	-65.3	-13.5	0	0	0	111.7	Y176 Y177	Y176-D179 VanDerWaalsContact O-CB 3.31Å; Y176-D179 WeakPolarHBondContact O-CB 3.19Å; Y176-D179 PolarHBondContact O-N 3.19Å; Y177-D179 VanDerWaalsContact C-N 3.32Å
180	F	95.2	Very high	90.5	Very high	2 Å²	2	57 Å²	57	1%	0.009	33%	0.328	C	S	.	.	H	α-helix	trans	-109.6	-27.5	-177.9	-64.9	-78.7	0	0	0	113.6	L70 L118 R133 V135 I172 Y176 Y177 Y178 T196 L197 F198	L70-F180 HydrophobicContact CD2-CB 4.2Å; L118-F180 HydrophobicContact CB-CE1 3.78Å; L118-F180 HydrophobicContact CB-CZ 4.01Å; L118-F180 HydrophobicContact CD1-CE1 4.19Å; L118-F180 HydrophobicContact CD1-CZ 3.96Å; L118-F180 HydrophobicContact CG-CZ 4.47Å; R133-F180 HydrophobicContact CB-CE1 3.6Å; R133-F180 HydrophobicContact CB-CE2 4.32Å; R133-F180 HydrophobicContact CB-CZ 3.44Å; R133-F180 VanDerWaalsContact CB-CZ 3.44Å; R133-F180 HydrophobicContact CG-CE1 4.1Å; R133-F180 HydrophobicContact CG-CZ 4.28Å; V135-F180 HydrophobicContact CG2-CE2 3.6Å; V135-F180 HydrophobicContact CG2-CZ 3.54Å; I172-F180 HydrophobicContact CD1-CD1 4.49Å; I172-F180 HydrophobicContact CD1-CD2 3.92Å; I172-F180 HydrophobicContact CD1-CE2 4.14Å; I172-F180 HydrophobicContact CD1-CG 4.1Å; I172-F180 HydrophobicContact CG2-CD2 3.69Å; I172-F180 HydrophobicContact CG2-CE2 4.12Å; Y176-F180 VanDerWaalsContact O-CD2 3.28Å; Y176-F180 WeakPolarHBondContact O-CD2 3.4Å; Y177-F180 PolarHBondContact O-N 3.37Å; Y178-F180 VanDerWaalsContact C-N 3.28Å; F180-T196 CarbonylContact O-C 3.57Å; F180-T196 WeakPolarHBondContact O-CA 3.27Å; F180-T196 WeakPolarHBondContact O-CB 3.44Å; F180-L197 HydrophobicContact CD1-CB 3.98Å; F180-L197 HydrophobicContact CD1-CD2 3.6Å; F180-L197 HydrophobicContact CD1-CG 4.45Å; F180-L197 HydrophobicContact CE1-CD2 3.61Å; F180-L197 PolarHBondContact O-N 3.43Å; F180-F198 HydrophobicContact CB-CE2 4.42Å; F180-F198 AromaticContact CD1-CE1 3.82Å; F180-F198 HydrophobicContact CD1-CE1 3.82Å; F180-F198 AromaticContact CD1-CE2 3.75Å; F180-F198 HydrophobicContact CD1-CE2 3.75Å; F180-F198 AromaticContact CD1-CZ 3.21Å; F180-F198 HydrophobicContact CD1-CZ 3.21Å; F180-F198 AromaticContact CE1-CE1 3.88Å; F180-F198 HydrophobicContact CE1-CE1 3.88Å; F180-F198 HydrophobicContact CE1-CE2 4.37Å; F180-F198 AromaticContact CE1-CZ 3.44Å; F180-F198 HydrophobicContact CE1-CZ 3.44Å; F180-F198 VanDerWaalsContact CE1-CZ 3.44Å; F180-F198 HydrophobicContact CG-CE2 4.27Å; F180-F198 HydrophobicContact CG-CZ 4.11Å; F180-F198 HydrophobicContact CZ-CZ 4.45Å
181	S	92.6	Very high	89.7	Confident	19 Å²	19	57.5 Å²	57.5	13%	0.133	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	153.6	178.4	60.3	0	0	0	0	112	Y177	Y177-S181 WeakPolarHBondContact CD1-OG 3.38Å; Y177-S181 WeakPolarHBondContact CE1-OG 3.41Å; Y177-S181 WeakPolarHBondContact O-CB 3.23Å; Y177-S181 PolarHBondContact O-N 3Å; Y177-S181 PolarHBondContact O-OG 3.12Å
182	G	89.4	Confident	89.2	Confident	48 Å²	48	59.1 Å²	59.1	50%	0.495	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	-136.6	-178.8	0	0	0	0	0	111.5	R195	G182-R195 WeakPolarHBondContact CA-O 3.41Å; G182-R195 PolarHBondContact N-O 3.41Å
183	G	89.6	Confident	88.8	Confident	46 Å²	46	59.1 Å²	59.1	47%	0.474	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	148.2	-177.8	0	0	0	0	0	113.6	R195	G183-R195 WeakPolarHBondContact O-CB 3.03Å; G183-R195 PolarHBondContact O-N 3.31Å
184	V	90.1	Very high	88.5	Confident	91 Å²	91	59.4 Å²	59.4	55%	0.552	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	146.2	175	-69.5	0	0	0	0	110.8	V192 A193 L194	V184-V192 HydrophobicContact CB-CG1 4.29Å; V184-V192 HydrophobicContact CG1-CG1 4.33Å; V184-A193 CarbonylContact C-O 3.55Å; V184-A193 WeakPolarHBondContact CA-O 3.42Å; V184-L194 HydrophobicContact CG1-CD1 3.49Å; V184-L194 VanDerWaalsContact CG1-CD1 3.49Å
185	S	86.1	Confident	88.4	Confident	46 Å²	46	63.1 Å²	63.1	32%	0.322	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.5	168.9	177.5	0	0	0	0	108.4	A193	S185-A193 PolarHBondContact N-O 2.87Å; S185-A193 PolarHBondContact O-N 2.92Å
186	W	84.4	Confident	88.2	Confident	171 Å²	171	61.1 Å²	61.1	65%	0.648	34%	0.342	S	S	*	.			trans	-148.1	154.5	-175.7	68.9	-80.1	0	0	0	112.1	V192	W186-V192 HydrophobicContact CB-CG1 4.37Å; W186-V192 HydrophobicContact CB-CG2 4.04Å
187	H	80.1	Confident	87.9	Confident	77 Å²	77	60.4 Å²	60.4	36%	0.356	34%	0.341	S	S	.	.			trans	-133.1	150	171.7	-61.7	-43.8	0	0	0	108.9	R156 G189 E190	R156-H187 PolarHBondContact NH1-CD2 2.99Å; R156-H187 VanDerWaalsContact NH1-CD2 3.32Å; R156-H187 PolarHBondContact NH1-NE2 3.49Å; H187-G189 PolarHBondContact O-N 2.81Å; H187-E190 HydrophobicContact CB-CB 4.26Å; H187-E190 HydrophobicContact CB-CG 4.35Å; H187-E190 IonicContact CD2-OE2 2.83Å; H187-E190 PolarHBondContact CD2-OE2 3.05Å; H187-E190 PolarHBondContact O-N 3.47Å
188	A	78.8	Confident	87.6	Confident	91 Å²	91	60.6 Å²	60.6	75%	0.752	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	133.4	178.9	0	0	0	0	0	110.7	E190	A188-E190 PolarHBondContact O-N 3.26Å
189	G	75.5	Confident	87.2	Confident	63 Å²	63	53.9 Å²	53.9	65%	0.649	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-4.3	-179	0	0	0	0	0	115.3	H187 G207	H187-G189 PolarHBondContact O-N 2.81Å; G189-G207 WeakPolarHBondContact O-CA 3.41Å
190	E	78.2	Confident	86.9	Confident	83 Å²	83	56 Å²	56	39%	0.388	33%	0.327	S	S	.	.	S	Bend	trans	-109.9	158.6	179.7	-67.1	-168.3	169.5	0	0	111.8	H187 A188 S205	H187-E190 HydrophobicContact CB-CB 4.26Å; H187-E190 HydrophobicContact CB-CG 4.35Å; H187-E190 IonicContact CD2-OE2 2.83Å; H187-E190 PolarHBondContact CD2-OE2 3.05Å; H187-E190 PolarHBondContact O-N 3.47Å; A188-E190 PolarHBondContact O-N 3.26Å; E190-S205 CarbonylContact C-O 3.51Å
191	P	81.6	Confident	86.5	Confident	11 Å²	11	56.5 Å²	56.5	7%	0.071	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65.3	156.3	169.9	29.9	-36.5	0	0	0	111.2	V202 C203 S205 M206	P191-V202 HydrophobicContact CB-CG1 3.61Å; P191-V202 HydrophobicContact CG-CG1 3.74Å; P191-C203 CarbonylContact C-O 3.52Å; P191-C203 WeakPolarHBondContact CB-O 3.31Å; P191-S205 VanDerWaalsContact CA-O 3.26Å; P191-S205 WeakPolarHBondContact CA-O 3.21Å; P191-M206 HydrophobicContact CB-SD 4.11Å; P191-M206 HydrophobicContact CG-SD 3.93Å
192	V	86.6	Confident	86.1	Confident	44 Å²	44	55.6 Å²	55.6	27%	0.267	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.2	179.9	179.4	0	0	0	0	109.5	V184 W186 V202 C203	V184-V192 HydrophobicContact CB-CG1 4.29Å; V184-V192 HydrophobicContact CG1-CG1 4.33Å; W186-V192 HydrophobicContact CB-CG1 4.37Å; W186-V192 HydrophobicContact CB-CG2 4.04Å; V192-V202 CarbonylContact O-C 3.44Å; V192-V202 WeakPolarHBondContact O-CA 3.43Å; V192-C203 PolarHBondContact N-O 3.09Å; V192-C203 PolarHBondContact O-N 2.99Å
193	A	87.7	Confident	85.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123	165.3	0	0	0	0	0	109.4	W157 V184 S185 W200 I201	W157-A193 HydrophobicContact CH2-CB 3.48Å; W157-A193 VanDerWaalsContact CH2-CB 3.48Å; W157-A193 HydrophobicContact CZ2-CB 3.99Å; W157-A193 HydrophobicContact CZ3-CB 3.94Å; V184-A193 CarbonylContact C-O 3.55Å; V184-A193 WeakPolarHBondContact CA-O 3.42Å; S185-A193 PolarHBondContact N-O 2.87Å; S185-A193 PolarHBondContact O-N 2.92Å; A193-W200 HydrophobicContact CB-CE3 4.03Å; A193-W200 HydrophobicContact CB-CZ3 4.21Å; A193-I201 CarbonylContact C-O 3.51Å; A193-I201 WeakPolarHBondContact CA-O 3.29Å
194	L	89.1	Confident	85.7	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.8	177.7	176.4	65.5	0	0	0	109	Q50 V184 T196 W200 I201	Q50-L194 HydrophobicContact CG-CD2 4.36Å; V184-L194 HydrophobicContact CG1-CD1 3.49Å; V184-L194 VanDerWaalsContact CG1-CD1 3.49Å; L194-T196 HydrophobicContact CD2-CG2 4.08Å; L194-T196 HydrophobicContact CG-CG2 3.98Å; L194-W200 WeakPolarHBondContact O-CA 3.5Å; L194-I201 HydrophobicContact CB-CG1 3.93Å; L194-I201 HydrophobicContact CD2-CD1 4.2Å; L194-I201 HydrophobicContact CD2-CG1 4.43Å; L194-I201 HydrophobicContact CG-CG1 4.45Å; L194-I201 PolarHBondContact N-O 3.36Å; L194-I201 PolarHBondContact O-N 3.45Å
195	R	91.2	Very high	85.3	Confident	151 Å²	151	49.6 Å²	49.6	57%	0.57	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	122.5	170.6	-170.4	178.3	178.6	-157.2	-1.1	108.2	G182 G183 W200	G182-R195 WeakPolarHBondContact CA-O 3.41Å; G182-R195 PolarHBondContact N-O 3.41Å; G183-R195 WeakPolarHBondContact O-CB 3.03Å; G183-R195 PolarHBondContact O-N 3.31Å; R195-W200 HydrophobicContact CB-CD2 4Å; R195-W200 HydrophobicContact CB-CE3 3.85Å; R195-W200 HydrophobicContact CB-CH2 3.74Å; R195-W200 HydrophobicContact CB-CZ2 3.87Å; R195-W200 HydrophobicContact CB-CZ3 3.72Å; R195-W200 HydrophobicContact CG-CD2 4.3Å; R195-W200 HydrophobicContact CG-CH2 4.44Å; R195-W200 HydrophobicContact CG-CZ2 4.06Å
196	T	91.6	Very high	84.8	Confident	12 Å²	12	49.9 Å²	49.9	7%	0.074	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	169.5	175	72.7	0	0	0	0	111	L70 F180 L194 F198 G199 I201	L70-T196 HydrophobicContact CD2-CG2 4.19Å; F180-T196 CarbonylContact O-C 3.57Å; F180-T196 WeakPolarHBondContact O-CA 3.27Å; F180-T196 WeakPolarHBondContact O-CB 3.44Å; L194-T196 HydrophobicContact CD2-CG2 4.08Å; L194-T196 HydrophobicContact CG-CG2 3.98Å; T196-F198 PolarHBondContact O-N 3.01Å; T196-F198 PolarHBondContact OG1-N 3.12Å; T196-F198 VanDerWaalsContact OG1-N 3.14Å; T196-G199 WeakPolarHBondContact CA-O 3.22Å; T196-G199 WeakPolarHBondContact CB-O 3.06Å; T196-G199 PolarHBondContact N-O 2.84Å; T196-G199 PolarHBondContact O-N 3.46Å; T196-G199 PolarHBondContact OG1-N 3.4Å; T196-G199 PolarHBondContact OG1-O 2.99Å; T196-I201 HydrophobicContact CG2-CD1 3.77Å; T196-I201 HydrophobicContact CG2-CG1 3.9Å; T196-I201 HydrophobicContact CG2-CG2 4.48Å
197	L	91.2	Very high	84.1	Confident	32 Å²	32	42.4 Å²	42.4	17%	0.168	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31	167.6	-173.7	73.8	0	0	0	111.9	Q131 R133 F180 G199	Q131-L197 HydrophobicContact CB-CD1 4.05Å; Q131-L197 VanDerWaalsContact CD-CD1 3.42Å; Q131-L197 HydrophobicContact CG-CD1 3.75Å; R133-L197 HydrophobicContact CB-CD2 4.23Å; R133-L197 HydrophobicContact CG-CD2 3.67Å; F180-L197 HydrophobicContact CD1-CB 3.98Å; F180-L197 HydrophobicContact CD1-CD2 3.6Å; F180-L197 HydrophobicContact CD1-CG 4.45Å; F180-L197 HydrophobicContact CE1-CD2 3.61Å; F180-L197 PolarHBondContact O-N 3.43Å; L197-G199 VanDerWaalsContact C-N 3.29Å; L197-G199 PolarHBondContact O-N 3.28Å
198	F	89.9	Confident	83.2	Confident	25 Å²	25	46.5 Å²	46.5	11%	0.11	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-1.5	-178.5	-46.6	-51.5	0	0	0	113.5	A52 A54 L118 I172 F180 T196	A52-F198 HydrophobicContact CB-CB 4.01Å; A52-F198 HydrophobicContact CB-CD2 3.51Å; A52-F198 HydrophobicContact CB-CE2 4.39Å; A52-F198 HydrophobicContact CB-CG 4.12Å; A54-F198 HydrophobicContact CB-CD1 3.62Å; A54-F198 HydrophobicContact CB-CD2 4.48Å; A54-F198 HydrophobicContact CB-CE1 3.47Å; A54-F198 VanDerWaalsContact CB-CE1 3.47Å; A54-F198 HydrophobicContact CB-CE2 4.34Å; A54-F198 HydrophobicContact CB-CG 4.13Å; A54-F198 HydrophobicContact CB-CZ 3.84Å; L118-F198 HydrophobicContact CB-CE1 3.93Å; L118-F198 HydrophobicContact CB-CZ 3.99Å; L118-F198 HydrophobicContact CD1-CZ 4.06Å; I172-F198 HydrophobicContact CD1-CE2 3.99Å; I172-F198 HydrophobicContact CD1-CZ 4.17Å; F180-F198 HydrophobicContact CB-CE2 4.42Å; F180-F198 AromaticContact CD1-CE1 3.82Å; F180-F198 HydrophobicContact CD1-CE1 3.82Å; F180-F198 AromaticContact CD1-CE2 3.75Å; F180-F198 HydrophobicContact CD1-CE2 3.75Å; F180-F198 AromaticContact CD1-CZ 3.21Å; F180-F198 HydrophobicContact CD1-CZ 3.21Å; F180-F198 AromaticContact CE1-CE1 3.88Å; F180-F198 HydrophobicContact CE1-CE1 3.88Å; F180-F198 HydrophobicContact CE1-CE2 4.37Å; F180-F198 AromaticContact CE1-CZ 3.44Å; F180-F198 HydrophobicContact CE1-CZ 3.44Å; F180-F198 VanDerWaalsContact CE1-CZ 3.44Å; F180-F198 HydrophobicContact CG-CE2 4.27Å; F180-F198 HydrophobicContact CG-CZ 4.11Å; F180-F198 HydrophobicContact CZ-CZ 4.45Å; T196-F198 PolarHBondContact O-N 3.01Å; T196-F198 PolarHBondContact OG1-N 3.12Å; T196-F198 VanDerWaalsContact OG1-N 3.14Å
199	G	87.6	Confident	82.5	Confident	32 Å²	32	44.3 Å²	44.3	33%	0.33	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	111	-170.2	-171.6	0	0	0	0	0	112.6	T196 L197	T196-G199 WeakPolarHBondContact CA-O 3.22Å; T196-G199 WeakPolarHBondContact CB-O 3.06Å; T196-G199 PolarHBondContact N-O 2.84Å; T196-G199 PolarHBondContact O-N 3.46Å; T196-G199 PolarHBondContact OG1-N 3.4Å; T196-G199 PolarHBondContact OG1-O 2.99Å; L197-G199 VanDerWaalsContact C-N 3.29Å; L197-G199 PolarHBondContact O-N 3.28Å
200	W	87.4	Confident	81.5	Confident	126 Å²	126	48.6 Å²	48.6	48%	0.477	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132.3	178.3	-71	94.7	0	0	0	111	V160 A193 L194 R195	V160-W200 WeakPolarHBondContact CG1-O 3.32Å; A193-W200 HydrophobicContact CB-CE3 4.03Å; A193-W200 HydrophobicContact CB-CZ3 4.21Å; L194-W200 WeakPolarHBondContact O-CA 3.5Å; R195-W200 HydrophobicContact CB-CD2 4Å; R195-W200 HydrophobicContact CB-CE3 3.85Å; R195-W200 HydrophobicContact CB-CH2 3.74Å; R195-W200 HydrophobicContact CB-CZ2 3.87Å; R195-W200 HydrophobicContact CB-CZ3 3.72Å; R195-W200 HydrophobicContact CG-CD2 4.3Å; R195-W200 HydrophobicContact CG-CH2 4.44Å; R195-W200 HydrophobicContact CG-CZ2 4.06Å
201	I	86.8	Confident	80.6	Confident	12 Å²	12	53 Å²	53	6%	0.062	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	158.9	171.3	68.9	175.4	0	0	0	110.3	Q50 A52 A193 L194 T196	Q50-I201 HydrophobicContact CB-CD1 3.88Å; Q50-I201 HydrophobicContact CG-CD1 4.48Å; A52-I201 HydrophobicContact CB-CG2 3.88Å; A193-I201 CarbonylContact C-O 3.51Å; A193-I201 WeakPolarHBondContact CA-O 3.29Å; L194-I201 HydrophobicContact CB-CG1 3.93Å; L194-I201 HydrophobicContact CD2-CD1 4.2Å; L194-I201 HydrophobicContact CD2-CG1 4.43Å; L194-I201 HydrophobicContact CG-CG1 4.45Å; L194-I201 PolarHBondContact N-O 3.36Å; L194-I201 PolarHBondContact O-N 3.45Å; T196-I201 HydrophobicContact CG2-CD1 3.77Å; T196-I201 HydrophobicContact CG2-CG1 3.9Å; T196-I201 HydrophobicContact CG2-CG2 4.48Å
202	V	84.9	Confident	79.5	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.6	177.2	-177.9	0	0	0	0	109	L48 W157 V160 Y161 P191 V192	L48-V202 HydrophobicContact CD1-CG1 4.09Å; W157-V202 HydrophobicContact CD2-CG2 4.42Å; W157-V202 HydrophobicContact CE3-CG2 4.43Å; V160-V202 HydrophobicContact CG1-CG2 4.42Å; Y161-V202 HydrophobicContact CD2-CB 3.91Å; Y161-V202 HydrophobicContact CD2-CG2 3.98Å; Y161-V202 HydrophobicContact CE1-CB 4.33Å; Y161-V202 HydrophobicContact CE2-CB 3.59Å; Y161-V202 HydrophobicContact CE2-CG2 4.17Å; Y161-V202 HydrophobicContact CG-CB 4.47Å; Y161-V202 HydrophobicContact CG-CG2 4.46Å; Y161-V202 PolarHBondContact OH-O 2.57Å; P191-V202 HydrophobicContact CB-CG1 3.61Å; P191-V202 HydrophobicContact CG-CG1 3.74Å; V192-V202 CarbonylContact O-C 3.44Å; V192-V202 WeakPolarHBondContact O-CA 3.43Å
203	C	86.4	Confident	78	Confident	8 Å²	8	67 Å²	67	5%	0.054	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	173.4	-177.5	63.3	0	0	0	0	111.8	Q50 P191 V192	Q50-C203 HydrophobicContact CB-CB 4.35Å; Q50-C203 HydrophobicContact CG-CB 3.52Å; P191-C203 CarbonylContact C-O 3.52Å; P191-C203 WeakPolarHBondContact CB-O 3.31Å; V192-C203 PolarHBondContact N-O 3.09Å; V192-C203 PolarHBondContact O-N 2.99Å
204	G	83.8	Confident	76.7	Confident	22 Å²	22	73.8 Å²	73.8	23%	0.227	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87	-164.7	176.2	0	0	0	0	0	113.7	V47 L48	V47-G204 WeakPolarHBondContact CA-O 3.41Å; L48-G204 PolarHBondContact N-O 2.66Å; L48-G204 PolarHBondContact O-N 2.92Å
205	S	81.9	Confident	75.3	Confident	28 Å²	28	80.1 Å²	80.1	20%	0.196	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	131.6	-173	-174.8	0	0	0	0	111.6	E190 P191 G207	E190-S205 CarbonylContact C-O 3.51Å; P191-S205 VanDerWaalsContact CA-O 3.26Å; P191-S205 WeakPolarHBondContact CA-O 3.21Å; S205-G207 PolarHBondContact O-N 2.74Å; S205-G207 PolarHBondContact OG-N 3Å
206	M	75.6	Confident	74	Confident	53 Å²	53	79.1 Å²	79.1	26%	0.261	40%	0.404	S	S	.	.			trans	-78.6	4.9	173.8	-69.7	-70.2	-62.6	0	0	114	R46 L48 P151 L153 P191	R46-M206 HydrophobicContact CB-CG 4.48Å; R46-M206 WeakPolarHBondContact O-CB 3.4Å; R46-M206 WeakPolarHBondContact O-CG 3.17Å; R46-M206 PolarHBondContact O-N 2.84Å; L48-M206 HydrophobicContact CD1-CG 4.15Å; L48-M206 HydrophobicContact CD1-SD 3.38Å; L48-M206 WeakPolarHBondContact CD1-SD 3.29Å; L48-M206 HydrophobicContact CD2-CG 4.5Å; L48-M206 HydrophobicContact CG-CG 3.96Å; L48-M206 HydrophobicContact CG-SD 3.89Å; P151-M206 HydrophobicContact CG-CE 3.95Å; L153-M206 HydrophobicContact CD2-CE 3.54Å; L153-M206 HydrophobicContact CD2-SD 4.24Å; P191-M206 HydrophobicContact CB-SD 4.11Å; P191-M206 HydrophobicContact CG-SD 3.93Å
207	G	69.3	Low	72.6	Confident	14 Å²	14	81.5 Å²	81.5	14%	0.144	42%	0.421	C	S	.	.			trans	91.4	-155.8	-175	0	0	0	0	0	112.6	G45 G189 S205	G45-G207 PolarHBondContact N-O 3.27Å; G189-G207 WeakPolarHBondContact O-CA 3.41Å; S205-G207 PolarHBondContact O-N 2.74Å; S205-G207 PolarHBondContact OG-N 3Å
208	E	63.2	Low	71.4	Confident	163 Å²	163	82.5 Å²	82.5	76%	0.762	43%	0.426	S	S	*	.	S	Bend	trans	-68.6	134.9	177.2	-69.5	-174.6	165.4	0	0	111
209	G	62.2	Low	70.4	Confident	44 Å²	44	84.9 Å²	84.9	45%	0.454	44%	0.437	S	S	.	.			trans	-169.9	169.5	179.2	0	0	0	0	0	111.2	K211	G209-K211 PolarHBondContact O-N 3.43Å
210	N	56.4	Low	69.5	Low	153 Å²	153	83.9 Å²	83.9	82%	0.818	43%	0.426	S	S	*	.			trans	-52.3	136.5	-179.1	-77.4	-12.4	0	0	0	111.7	L212	N210-L212 PolarHBondContact O-N 3.09Å
211	K	57.6	Low	68.8	Low	177 Å²	177	80.1 Å²	80.1	77%	0.77	42%	0.415	S	S	*	.			trans	-51.3	111.3	175.8	-67.4	179.4	179.4	177.8	0	109.8	G209	G209-K211 PolarHBondContact O-N 3.43Å
212	L	58.4	Low	68.1	Low	108 Å²	108	80.2 Å²	80.2	57%	0.565	42%	0.416	S	S	*	.			trans	-89.5	122.4	168.7	-70	169.9	0	0	0	108.2	R46 N210 N214	R46-L212 HydrophobicContact CB-CD1 3.73Å; R46-L212 HydrophobicContact CG-CD1 3.96Å; N210-L212 PolarHBondContact O-N 3.09Å; L212-N214 PolarHBondContact O-N 2.98Å
213	R	56.3	Low	67.6	Low	241 Å²	241	85.2 Å²	85.2	91%	0.909	44%	0.437	S	S	*	.			trans	-73.8	-15.6	176.5	-71.2	-174.2	175.5	-174	-1.3	113.3	V215	R213-V215 PolarHBondContact O-N 3.43Å
214	N	59	Low	66.8	Low	142 Å²	142	89 Å²	89	76%	0.759	45%	0.454	S	S	*	.			trans	-87.9	110.7	-173.9	-66.5	-10.2	0	0	0	110.8	L212	L212-N214 PolarHBondContact O-N 2.98Å
215	V	61.3	Low	66	Low	138 Å²	138	88.3 Å²	88.3	84%	0.836	45%	0.446	S	S	*	.			trans	-90.9	133.3	170.1	-178	0	0	0	0	108.7	R213	R213-V215 PolarHBondContact O-N 3.43Å
216	R	62.9	Low	65.2	Low	131 Å²	131	88.4 Å²	88.4	49%	0.494	45%	0.446	S	S	.	.			trans	-116.3	124.5	168.3	-68	-175.1	-175.4	-166.8	-2.9	108.1
217	S	63.2	Low	64.6	Low	62 Å²	62	87.1 Å²	87.1	43%	0.434	44%	0.44	S	S	.	.			trans	-118.5	132.4	168.6	-177.6	0	0	0	0	108.2	L101	L101-S217 WeakPolarHBondContact CD2-OG 3.34Å
218	L	64.6	Low	64.3	Low	53 Å²	53	87.9 Å²	87.9	28%	0.277	44%	0.439	S	S	.	.			trans	-118.4	116.6	172.9	-59.8	174.7	0	0	0	105.4	L49 L69 D71 C144	L49-L218 HydrophobicContact CD1-CD1 4.03Å; L69-L218 HydrophobicContact CD2-CD1 3.56Å; D71-L218 WeakPolarHBondContact OD2-CB 3.35Å; C144-L218 HydrophobicContact CB-CD2 4.23Å
219	H	70.5	Confident	64.4	Low	74 Å²	74	83.6 Å²	83.6	34%	0.343	42%	0.421	S	S	.	.			trans	-147	130.3	176.3	178.3	60.8	0	0	0	107.1	G73 T100 L101	G73-H219 WeakPolarHBondContact O-CA 3.48Å; G73-H219 PolarHBondContact O-ND1 2.8Å; T100-H219 WeakPolarHBondContact CA-O 3.49Å; L101-H219 HydrophobicContact CB-CB 4.36Å; L101-H219 HydrophobicContact CD1-CB 4.37Å
220	A	67.1	Low	64.5	Low	11 Å²	11	81.9 Å²	81.9	9%	0.091	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-138.3	105.6	175.1	0	0	0	0	0	108.6	G73 Q75 F78 I98 F99	G73-A220 PolarHBondContact O-N 2.91Å; Q75-A220 PolarHBondContact N-O 3.42Å; F78-A220 HydrophobicContact CE2-CB 3.87Å; F78-A220 HydrophobicContact CZ-CB 4.19Å; I98-A220 HydrophobicContact CG2-CB 4.21Å; F99-A220 WeakPolarHBondContact O-CA 3.19Å
221	L	73.2	Confident	64.9	Low	48 Å²	48	77.2 Å²	77.2	25%	0.251	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125.9	163.1	175.6	85.8	0	0	0	106.6	Q75 F99 K223	Q75-L221 HydrophobicContact CG-CD1 4.43Å; Q75-L221 VanDerWaalsContact NE2-CD1 3.28Å; F99-L221 HydrophobicContact CB-CB 4.18Å; F99-L221 HydrophobicContact CB-CD2 4.43Å; F99-L221 HydrophobicContact CD2-CD2 4.06Å; F99-L221 HydrophobicContact CD2-CG 4.49Å; F99-L221 HydrophobicContact CG-CD2 4.32Å; F99-L221 PolarHBondContact N-O 2.86Å; F99-L221 PolarHBondContact O-N 3.39Å; F99-L221 VanDerWaalsContact O-N 3.11Å; L221-K223 HydrophobicContact CD2-CG 4.46Å
222	V	73.2	Confident	65.2	Low	14 Å²	14	72.9 Å²	72.9	9%	0.085	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.1	176.7	-177.4	0	0	0	0	108.4	R76 F78 V96 E97 I98 L138	R76-V222 HydrophobicContact CB-CB 4.4Å; R76-V222 HydrophobicContact CB-CG2 3.79Å; R76-V222 HydrophobicContact CG-CB 3.68Å; R76-V222 HydrophobicContact CG-CG1 4.21Å; R76-V222 HydrophobicContact CG-CG2 3.64Å; F78-V222 HydrophobicContact CE1-CG2 4.29Å; F78-V222 HydrophobicContact CZ-CG2 3.6Å; V96-V222 HydrophobicContact CB-CG1 4Å; V96-V222 HydrophobicContact CG1-CG1 4.23Å; E97-V222 WeakPolarHBondContact O-CA 3.42Å; I98-V222 HydrophobicContact CG1-CG2 4.36Å; L138-V222 HydrophobicContact CD1-CG1 4.03Å
223	K	74	Confident	65.5	Low	105 Å²	105	72.6 Å²	72.6	46%	0.457	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.6	168.4	-63.3	-174	-178.2	178.3	0	109.2	E97 F99 L221	E97-K223 HydrophobicContact CB-CB 4.43Å; E97-K223 PolarHBondContact N-O 3.28Å; E97-K223 VanDerWaalsContact N-O 3.1Å; E97-K223 PolarHBondContact O-N 3.47Å; F99-K223 HydrophobicContact CD2-CG 4.46Å; F99-K223 HydrophobicContact CE2-CB 4.26Å; F99-K223 HydrophobicContact CE2-CD 3.74Å; F99-K223 HydrophobicContact CE2-CG 3.89Å; F99-K223 HydrophobicContact CZ-CD 4.17Å; L221-K223 HydrophobicContact CD2-CG 4.46Å
224	E	69.3	Low	65.8	Low	87 Å²	87	63 Å²	63	41%	0.407	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	140.8	164.5	-70	-179.9	-144.4	0	0	108.3	P226 I229 K232	E224-P226 WeakPolarHBondContact O-CD 3.49Å; E224-I229 HydrophobicContact CB-CD1 4.06Å; E224-I229 HydrophobicContact CB-CG1 4.05Å; E224-K232 IonicContact OE2-NZ 3.74Å; E224-K232 PolarHBondContact OE2-NZ 3.09Å
225	D	66.4	Low	65.8	Low	9 Å²	9	58.8 Å²	58.8	5%	0.048	29%	0.289	C	S	.	.			trans	-54.7	124	174.4	168.2	42.2	0	0	0	109.9	Y95 N227 E228 I229 R231	Y95-D225 WeakPolarHBondContact O-CB 3.3Å; Y95-D225 PolarHBondContact O-N 2.86Å; D225-N227 PolarHBondContact O-N 3.35Å; D225-N227 VanDerWaalsContact O-N 3.1Å; D225-N227 PolarHBondContact OD1-N 3.02Å; D225-N227 WeakPolarHBondContact OD2-CB 3.37Å; D225-E228 HydrophobicContact CB-CB 4.05Å; D225-E228 WeakPolarHBondContact O-CA 3.39Å; D225-E228 WeakPolarHBondContact O-CB 3.32Å; D225-E228 PolarHBondContact O-N 3.3Å; D225-E228 PolarHBondContact OD2-N 2.82Å; D225-E228 VanDerWaalsContact OD2-N 3.13Å; D225-I229 PolarHBondContact O-N 3.45Å; D225-R231 IonicContact OD2-NH2 2.73Å; D225-R231 PolarHBondContact OD2-NH2 3.03Å
226	P	64.9	Low	65.5	Low	30 Å²	30	57.3 Å²	57.3	20%	0.195	28%	0.276	C	S	.	.	H	α-helix	trans	-53.2	-32.5	177.7	-27.6	35.1	0	0	0	112.9	E224 I229 L230	E224-P226 WeakPolarHBondContact O-CD 3.49Å; P226-I229 PolarHBondContact O-N 2.94Å; P226-L230 WeakPolarHBondContact O-CB 3.42Å; P226-L230 WeakPolarHBondContact O-CG 3.11Å; P226-L230 PolarHBondContact O-N 2.83Å
227	N	62.8	Low	64.9	Low	26 Å²	26	57.7 Å²	57.7	14%	0.139	28%	0.284	C	S	.	.	H	α-helix	trans	-72.2	-31.6	176.9	-58.7	-32.1	0	0	0	112.1	D225 R231 S395	D225-N227 PolarHBondContact O-N 3.35Å; D225-N227 VanDerWaalsContact O-N 3.1Å; D225-N227 PolarHBondContact OD1-N 3.02Å; D225-N227 WeakPolarHBondContact OD2-CB 3.37Å; N227-R231 WeakPolarHBondContact O-CB 3.24Å; N227-R231 WeakPolarHBondContact O-CG 3.36Å; N227-R231 PolarHBondContact O-N 2.93Å; N227-R231 PolarHBondContact O-NE 3.32Å; N227-R231 VanDerWaalsContact O-NE 3.16Å; N227-S395 WeakPolarHBondContact ND2-CB 3.38Å; N227-S395 PolarHBondContact ND2-OG 3.31Å
228	E	63.8	Low	64.3	Low	29 Å²	29	56.3 Å²	56.3	14%	0.136	28%	0.276	C	S	.	.	H	α-helix	trans	-67.5	-38.1	170.8	-156.5	-173.1	132	0	0	111.6	Y95 D225 R231 K232	Y95-E228 PolarHBondContact N-OE2 3.17Å; D225-E228 HydrophobicContact CB-CB 4.05Å; D225-E228 WeakPolarHBondContact O-CA 3.39Å; D225-E228 WeakPolarHBondContact O-CB 3.32Å; D225-E228 PolarHBondContact O-N 3.3Å; D225-E228 PolarHBondContact OD2-N 2.82Å; D225-E228 VanDerWaalsContact OD2-N 3.13Å; E228-R231 PolarHBondContact O-N 3.08Å; E228-K232 WeakPolarHBondContact O-CG 3.34Å; E228-K232 PolarHBondContact O-N 3.3Å; E228-K232 VanDerWaalsContact OE1-CE 3.26Å; E228-K232 WeakPolarHBondContact OE1-CE 3.4Å; E228-K232 IonicContact OE1-NZ 3.31Å; E228-K232 PolarHBondContact OE1-NZ 2.89Å
229	I	65.3	Low	63.1	Low	73 Å²	73	60.3 Å²	60.3	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-46.8	173.4	-63.2	169.3	0	0	0	110.6	E224 D225 P226 R231 K232 F233	E224-I229 HydrophobicContact CB-CD1 4.06Å; E224-I229 HydrophobicContact CB-CG1 4.05Å; D225-I229 PolarHBondContact O-N 3.45Å; P226-I229 PolarHBondContact O-N 2.94Å; I229-R231 VanDerWaalsContact C-N 3.31Å; I229-R231 PolarHBondContact O-N 3.38Å; I229-K232 PolarHBondContact O-N 3.47Å; I229-F233 WeakPolarHBondContact O-CB 3.2Å; I229-F233 PolarHBondContact O-N 3.42Å
230	L	64.9	Low	62.1	Low	8 Å²	8	60.6 Å²	60.6	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-42.2	175.9	-75.6	171.2	0	0	0	111.2	P226 F233 W234 L393 L464	P226-L230 WeakPolarHBondContact O-CB 3.42Å; P226-L230 WeakPolarHBondContact O-CG 3.11Å; P226-L230 PolarHBondContact O-N 2.83Å; L230-F233 WeakPolarHBondContact O-CB 3.2Å; L230-F233 PolarHBondContact O-N 3.26Å; L230-W234 HydrophobicContact CB-CE3 4.37Å; L230-W234 HydrophobicContact CB-CH2 3.81Å; L230-W234 HydrophobicContact CB-CZ2 3.99Å; L230-W234 HydrophobicContact CB-CZ3 4.01Å; L230-W234 HydrophobicContact CD1-CH2 4.28Å; L230-W234 HydrophobicContact CD1-CZ2 4.5Å; L230-W234 HydrophobicContact CD2-CZ2 4.05Å; L230-W234 HydrophobicContact CG-CH2 4.45Å; L230-W234 HydrophobicContact CG-CZ2 4.41Å; L230-W234 VanDerWaalsContact O-CG 3.29Å; L230-W234 PolarHBondContact O-N 2.78Å; L230-L393 HydrophobicContact CD1-CD2 4.01Å; L230-L464 HydrophobicContact CD2-CD2 3.98Å
231	R	63.4	Low	61.2	Low	56 Å²	56	64.8 Å²	64.8	21%	0.211	34%	0.34	C	S	.	.	H	α-helix	trans	-58.5	-52.4	172.8	-79.5	179	-82.4	-165	1.1	111.8	D225 N227 E228 I229 F233 W234 D235 N386	D225-R231 IonicContact OD2-NH2 2.73Å; D225-R231 PolarHBondContact OD2-NH2 3.03Å; N227-R231 WeakPolarHBondContact O-CB 3.24Å; N227-R231 WeakPolarHBondContact O-CG 3.36Å; N227-R231 PolarHBondContact O-N 2.93Å; N227-R231 PolarHBondContact O-NE 3.32Å; N227-R231 VanDerWaalsContact O-NE 3.16Å; E228-R231 PolarHBondContact O-N 3.08Å; I229-R231 VanDerWaalsContact C-N 3.31Å; I229-R231 PolarHBondContact O-N 3.38Å; R231-F233 PolarHBondContact O-N 3.07Å; R231-W234 PolarHBondContact O-N 3.21Å; R231-W234 VanDerWaalsContact O-N 3.12Å; R231-D235 WeakPolarHBondContact O-CB 3.33Å; R231-D235 PolarHBondContact O-N 2.98Å; R231-N386 WeakPolarHBondContact CD-OD1 3.21Å; R231-N386 PolarHBondContact NH1-OD1 2.86Å
232	K	64.8	Low	59.8	Low	86 Å²	86	68.9 Å²	68.9	37%	0.374	35%	0.352	S	S	.	.	H	α-helix	trans	-58.2	-35	176.6	-72.7	172	-170.1	162.2	0	112.4	E224 E228 I229 D235 L236	E224-K232 IonicContact OE2-NZ 3.74Å; E224-K232 PolarHBondContact OE2-NZ 3.09Å; E228-K232 WeakPolarHBondContact O-CG 3.34Å; E228-K232 PolarHBondContact O-N 3.3Å; E228-K232 VanDerWaalsContact OE1-CE 3.26Å; E228-K232 WeakPolarHBondContact OE1-CE 3.4Å; E228-K232 IonicContact OE1-NZ 3.31Å; E228-K232 PolarHBondContact OE1-NZ 2.89Å; I229-K232 PolarHBondContact O-N 3.47Å; K232-D235 WeakPolarHBondContact O-CB 3.38Å; K232-L236 WeakPolarHBondContact O-CG 3.2Å; K232-L236 PolarHBondContact O-N 3.47Å
233	F	63.7	Low	58.5	Low	101 Å²	101	75 Å²	75	44%	0.443	38%	0.384	S	S	.	.	H	α-helix	trans	-67.8	-45.3	175.3	179.4	-95.4	0	0	0	111.8	I229 L230 R231 L236 E237	I229-F233 WeakPolarHBondContact O-CB 3.2Å; I229-F233 PolarHBondContact O-N 3.42Å; L230-F233 WeakPolarHBondContact O-CB 3.2Å; L230-F233 PolarHBondContact O-N 3.26Å; R231-F233 PolarHBondContact O-N 3.07Å; F233-L236 WeakPolarHBondContact O-CB 3.44Å; F233-L236 PolarHBondContact O-N 3.35Å; F233-E237 HydrophobicContact CE1-CG 4.17Å; F233-E237 HydrophobicContact CZ-CG 4.42Å; F233-E237 PolarHBondContact O-N 2.95Å; F233-E237 VanDerWaalsContact O-N 3.09Å
234	W	63.5	Low	56.9	Low	40 Å²	40	74.1 Å²	74.1	15%	0.152	40%	0.396	C	S	.	.	H	α-helix	trans	-72.4	-32.5	177.9	-62.5	-37.8	0	0	0	113.7	L230 R231 L236 E237 A238 L393 L451	L230-W234 HydrophobicContact CB-CE3 4.37Å; L230-W234 HydrophobicContact CB-CH2 3.81Å; L230-W234 HydrophobicContact CB-CZ2 3.99Å; L230-W234 HydrophobicContact CB-CZ3 4.01Å; L230-W234 HydrophobicContact CD1-CH2 4.28Å; L230-W234 HydrophobicContact CD1-CZ2 4.5Å; L230-W234 HydrophobicContact CD2-CZ2 4.05Å; L230-W234 HydrophobicContact CG-CH2 4.45Å; L230-W234 HydrophobicContact CG-CZ2 4.41Å; L230-W234 VanDerWaalsContact O-CG 3.29Å; L230-W234 PolarHBondContact O-N 2.78Å; R231-W234 PolarHBondContact O-N 3.21Å; R231-W234 VanDerWaalsContact O-N 3.12Å; W234-L236 PolarHBondContact O-N 3.4Å; W234-E237 CarbonylContact O-C 3.57Å; W234-E237 PolarHBondContact O-N 3.47Å; W234-A238 WeakPolarHBondContact O-CB 3.34Å; W234-A238 PolarHBondContact O-N 3.39Å; W234-L393 HydrophobicContact CH2-CB 4.33Å; W234-L393 HydrophobicContact CH2-CD2 3.48Å; W234-L393 VanDerWaalsContact CH2-CD2 3.48Å; W234-L393 HydrophobicContact CZ3-CB 4.37Å; W234-L393 HydrophobicContact CZ3-CD2 3.99Å; W234-L451 HydrophobicContact CD2-CD1 4.2Å; W234-L451 HydrophobicContact CE3-CD1 4.34Å; W234-L451 HydrophobicContact CH2-CD1 3.4Å; W234-L451 HydrophobicContact CZ2-CB 3.93Å; W234-L451 HydrophobicContact CZ2-CD1 3.24Å; W234-L451 HydrophobicContact CZ2-CG 4.17Å; W234-L451 HydrophobicContact CZ3-CD1 3.97Å
235	D	60	Low	55.7	Low	54 Å²	54	75.3 Å²	75.3	29%	0.289	40%	0.402	S	S	.	.	H	α-helix	trans	-54.6	-34.7	169.1	-80.5	2.8	0	0	0	111.9	R231 K232 R242	R231-D235 WeakPolarHBondContact O-CB 3.33Å; R231-D235 PolarHBondContact O-N 2.98Å; K232-D235 WeakPolarHBondContact O-CB 3.38Å; D235-R242 VanDerWaalsContact CB-CZ 3.42Å; D235-R242 WeakPolarHBondContact O-CD 3.44Å; D235-R242 IonicContact OD1-CZ 3.13Å; D235-R242 IonicContact OD1-NE 3.41Å; D235-R242 IonicContact OD1-NH1 2.66Å; D235-R242 IonicContact OD1-NH2 3.41Å; D235-R242 PolarHBondContact OD1-NH2 2.88Å; D235-R242 IonicContact OD2-CZ 3.57Å; D235-R242 IonicContact OD2-NH1 3.96Å; D235-R242 PolarHBondContact OD2-NH1 3.38Å; D235-R242 IonicContact OD2-NH2 3.98Å; D235-R242 PolarHBondContact OD2-NH2 3.46Å
236	L	53.5	Low	54.8	Low	106 Å²	106	81.8 Å²	81.8	56%	0.555	43%	0.431	S	S	*	.	H	α-helix	trans	-77.9	-38.2	172.5	-67.5	165.4	0	0	0	111.8	K232 F233 W234 A238 L239	K232-L236 WeakPolarHBondContact O-CG 3.2Å; K232-L236 PolarHBondContact O-N 3.47Å; F233-L236 WeakPolarHBondContact O-CB 3.44Å; F233-L236 PolarHBondContact O-N 3.35Å; W234-L236 PolarHBondContact O-N 3.4Å; L236-A238 PolarHBondContact O-N 3.46Å; L236-L239 HydrophobicContact CB-CD1 4.34Å; L236-L239 HydrophobicContact CD2-CD1 4.11Å; L236-L239 WeakPolarHBondContact O-CB 3.25Å; L236-L239 WeakPolarHBondContact O-CD1 3.45Å; L236-L239 WeakPolarHBondContact O-CG 3.33Å; L236-L239 PolarHBondContact O-N 2.96Å
237	E	51.4	Low	53.8	Low	140 Å²	140	84.9 Å²	84.9	65%	0.654	46%	0.46	S	S	*	.	H	α-helix	trans	-68.3	-24.5	173.5	-67.6	-161.6	156.2	0	0	113	F233 W234 L239	F233-E237 HydrophobicContact CE1-CG 4.17Å; F233-E237 HydrophobicContact CZ-CG 4.42Å; F233-E237 PolarHBondContact O-N 2.95Å; F233-E237 VanDerWaalsContact O-N 3.09Å; W234-E237 CarbonylContact O-C 3.57Å; W234-E237 PolarHBondContact O-N 3.47Å; E237-L239 PolarHBondContact O-N 3.38Å
238	A	50.1	Low	53.1	Low	32 Å²	32	91.1 Å²	91.1	26%	0.264	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	8.3	169.9	0	0	0	0	0	113.3	W234 L236 G240 I241 R242	W234-A238 WeakPolarHBondContact O-CB 3.34Å; W234-A238 PolarHBondContact O-N 3.39Å; L236-A238 PolarHBondContact O-N 3.46Å; A238-G240 PolarHBondContact O-N 2.71Å; A238-I241 PolarHBondContact O-N 3.13Å; A238-R242 HydrophobicContact CB-CG 4.48Å
239	L	39.7	Very low	52.3	Low	138 Å²	138	95.5 Å²	95.5	72%	0.723	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	97.9	169.1	-81.8	164.5	0	0	0	109.1	L236 E237	L236-L239 HydrophobicContact CB-CD1 4.34Å; L236-L239 HydrophobicContact CD2-CD1 4.11Å; L236-L239 WeakPolarHBondContact O-CB 3.25Å; L236-L239 WeakPolarHBondContact O-CD1 3.45Å; L236-L239 WeakPolarHBondContact O-CG 3.33Å; L236-L239 PolarHBondContact O-N 2.96Å; E237-L239 PolarHBondContact O-N 3.38Å
240	G	48.3	Very low	51.7	Low	80 Å²	80	97 Å²	97	83%	0.825	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	137.8	-20.5	-172.8	0	0	0	0	0	114.5	A238	A238-G240 PolarHBondContact O-N 2.71Å
241	I	49.1	Very low	50.9	Low	99 Å²	99	104.5 Å²	104.5	51%	0.508	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-8.9	179.3	-54.1	178.3	0	0	0	111.9	A238 T358	A238-I241 PolarHBondContact O-N 3.13Å; I241-T358 HydrophobicContact CD1-CG2 4.38Å
242	R	43.3	Very low	50.5	Low	134 Å²	134	105 Å²	105	51%	0.506	56%	0.561	S	S	.	*	S	Bend	trans	-89.7	142.6	-177.2	-65.7	-174.3	139.3	-147.8	-15.5	113.4	D235 A238 A244	D235-R242 VanDerWaalsContact CB-CZ 3.42Å; D235-R242 WeakPolarHBondContact O-CD 3.44Å; D235-R242 IonicContact OD1-CZ 3.13Å; D235-R242 IonicContact OD1-NE 3.41Å; D235-R242 IonicContact OD1-NH1 2.66Å; D235-R242 IonicContact OD1-NH2 3.41Å; D235-R242 PolarHBondContact OD1-NH2 2.88Å; D235-R242 IonicContact OD2-CZ 3.57Å; D235-R242 IonicContact OD2-NH1 3.96Å; D235-R242 PolarHBondContact OD2-NH1 3.38Å; D235-R242 IonicContact OD2-NH2 3.98Å; D235-R242 PolarHBondContact OD2-NH2 3.46Å; A238-R242 HydrophobicContact CB-CG 4.48Å; R242-A244 PolarHBondContact O-N 3.18Å
243	D	47.5	Very low	50.6	Low	143 Å²	143	103.5 Å²	103.5	77%	0.765	56%	0.559	S	S	*	*			trans	-64.9	19.8	-175.9	-72.7	-41.5	0	0	0	116.5	E245	D243-E245 VanDerWaalsContact C-N 3.31Å; D243-E245 PolarHBondContact O-N 3.48Å
244	A	39.4	Very low	51.1	Low	85 Å²	85	103.4 Å²	103.4	70%	0.702	56%	0.56	S	S	*	*			trans	-85.5	72	177.4	0	0	0	0	0	111	R242	R242-A244 PolarHBondContact O-N 3.18Å
245	E	44.9	Very low	51.5	Low	113 Å²	113	104.4 Å²	104.4	53%	0.528	58%	0.577	S	S	.	*			trans	-177.1	95.5	144.4	-106.2	170.8	156.5	0	0	108.1	D243 A247 R248	D243-E245 VanDerWaalsContact C-N 3.31Å; D243-E245 PolarHBondContact O-N 3.48Å; E245-A247 PolarHBondContact O-N 2.9Å; E245-R248 PolarHBondContact O-N 3.39Å; E245-R248 IonicContact OE2-CZ 3.18Å; E245-R248 IonicContact OE2-NH1 3.81Å; E245-R248 PolarHBondContact OE2-NH1 3.19Å; E245-R248 IonicContact OE2-NH2 2.91Å; E245-R248 PolarHBondContact OE2-NH2 3.41Å
246	E	46.7	Very low	52.4	Low	144 Å²	144	104.1 Å²	104.1	67%	0.673	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-48.4	-15.5	173.3	-107.5	161.2	166.3	0	0	114.5	R249	E246-R249 IonicContact OE1-CZ 3.5Å; E246-R249 IonicContact OE1-NH1 2.67Å; E246-R249 PolarHBondContact OE1-NH1 2.92Å; E246-R249 IonicContact OE1-NH2 2.63Å; E246-R249 PolarHBondContact OE1-NH2 3.4Å
247	A	44.2	Very low	53.6	Low	96 Å²	96	104.2 Å²	104.2	79%	0.793	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-77.3	-21.7	176.8	0	0	0	0	0	115.4	E245	E245-A247 PolarHBondContact O-N 2.9Å
248	R	47.3	Very low	55	Low	157 Å²	157	102 Å²	102	59%	0.592	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-93.8	-0.5	178.1	-74.8	-167.9	-70.6	-83.2	-6.6	114.3	E245 S250	E245-R248 PolarHBondContact O-N 3.39Å; E245-R248 IonicContact OE2-CZ 3.18Å; E245-R248 IonicContact OE2-NH1 3.81Å; E245-R248 PolarHBondContact OE2-NH1 3.19Å; E245-R248 IonicContact OE2-NH2 2.91Å; E245-R248 PolarHBondContact OE2-NH2 3.41Å; R248-S250 PolarHBondContact O-N 3.43Å
249	R	48	Very low	56.6	Low	120 Å²	120	102.3 Å²	102.3	45%	0.453	55%	0.552	S	S	.	*	H	α-helix	trans	-58.3	-35.7	-168.7	-83.8	-176.1	174.1	164.5	5.8	115.4	E246 Q251 T253	E246-R249 IonicContact OE1-CZ 3.5Å; E246-R249 IonicContact OE1-NH1 2.67Å; E246-R249 PolarHBondContact OE1-NH1 2.92Å; E246-R249 IonicContact OE1-NH2 2.63Å; E246-R249 PolarHBondContact OE1-NH2 3.4Å; R249-Q251 PolarHBondContact O-N 3.39Å; R249-T253 WeakPolarHBondContact O-CB 3.3Å; R249-T253 PolarHBondContact O-N 3.07Å; R249-T253 PolarHBondContact O-OG1 2.69Å
250	S	52.1	Low	58.6	Low	106 Å²	106	98 Å²	98	74%	0.741	53%	0.529	S	S	*	.	H	α-helix	trans	-64.9	-47.3	-166.5	78.4	0	0	0	0	114.2	R248 E254	R248-S250 PolarHBondContact O-N 3.43Å; S250-E254 WeakPolarHBondContact O-CB 3.46Å; S250-E254 PolarHBondContact O-N 3.28Å
251	Q	47.7	Very low	60.4	Low	165 Å²	165	100.4 Å²	100.4	77%	0.771	52%	0.519	S	S	*	.	H	α-helix	trans	-82.5	-41.9	-178.7	-83	-179.1	-12.7	0	0	113.3	R249 E254 A255	R249-Q251 PolarHBondContact O-N 3.39Å; Q251-E254 PolarHBondContact O-N 2.89Å; Q251-A255 PolarHBondContact O-N 2.87Å; Q251-A255 VanDerWaalsContact O-N 3.1Å
252	S	55.9	Low	62.1	Low	66 Å²	66	98.5 Å²	98.5	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-67.4	-43.4	-179.7	-59.9	0	0	0	0	111.1	E254 A255 I256	S252-E254 VanDerWaalsContact C-N 3.3Å; S252-E254 PolarHBondContact O-N 3.32Å; S252-A255 PolarHBondContact O-N 3.06Å; S252-I256 WeakPolarHBondContact O-CB 3.46Å; S252-I256 WeakPolarHBondContact O-CD1 3.46Å; S252-I256 WeakPolarHBondContact O-CG1 3.32Å; S252-I256 PolarHBondContact O-N 3.41Å
253	T	66	Low	64.2	Low	55 Å²	55	92.9 Å²	92.9	34%	0.337	49%	0.489	S	S	.	.	H	α-helix	trans	-68	-31.8	179.9	-45.2	0	0	0	0	111.8	R249 R257	R249-T253 WeakPolarHBondContact O-CB 3.3Å; R249-T253 PolarHBondContact O-N 3.07Å; R249-T253 PolarHBondContact O-OG1 2.69Å; T253-R257 VanDerWaalsContact O-CB 3.23Å; T253-R257 WeakPolarHBondContact O-CB 3.12Å; T253-R257 PolarHBondContact O-N 3.39Å
254	E	74	Confident	66	Low	98 Å²	98	89.3 Å²	89.3	46%	0.458	47%	0.473	S	S	.	.	H	α-helix	trans	-67.8	-48.5	174.7	-165.6	61.3	-143.4	0	0	112.2	S250 Q251 S252 I256 R257 H258	S250-E254 WeakPolarHBondContact O-CB 3.46Å; S250-E254 PolarHBondContact O-N 3.28Å; Q251-E254 PolarHBondContact O-N 2.89Å; S252-E254 VanDerWaalsContact C-N 3.3Å; S252-E254 PolarHBondContact O-N 3.32Å; E254-I256 VanDerWaalsContact C-N 3.28Å; E254-I256 PolarHBondContact O-N 3.18Å; E254-R257 PolarHBondContact O-N 3.49Å; E254-R257 IonicContact OE1-NH1 3.64Å; E254-R257 IonicContact OE2-CZ 2.71Å; E254-R257 IonicContact OE2-NH1 2.72Å; E254-R257 PolarHBondContact OE2-NH1 3.45Å; E254-H258 VanDerWaalsContact O-CB 3.29Å; E254-H258 WeakPolarHBondContact O-CB 3.35Å; E254-H258 PolarHBondContact O-N 3.15Å
255	A	73.5	Confident	68.3	Low	62 Å²	62	89.8 Å²	89.8	51%	0.512	46%	0.459	S	S	.	.	H	α-helix	trans	-61.9	-38.6	178.2	0	0	0	0	0	111.8	Q251 S252 Y259	Q251-A255 PolarHBondContact O-N 2.87Å; Q251-A255 VanDerWaalsContact O-N 3.1Å; S252-A255 PolarHBondContact O-N 3.06Å; A255-Y259 VanDerWaalsContact O-CB 3.32Å; A255-Y259 WeakPolarHBondContact O-CB 3.43Å; A255-Y259 PolarHBondContact O-N 3.26Å
256	I	76.9	Confident	70.2	Confident	48 Å²	48	88.7 Å²	88.7	25%	0.246	45%	0.454	C	S	.	.	H	α-helix	trans	-65.2	-47.9	175.1	-65.3	173.9	0	0	0	110.5	S252 E254 Y259 I260 F359 M363	S252-I256 WeakPolarHBondContact O-CB 3.46Å; S252-I256 WeakPolarHBondContact O-CD1 3.46Å; S252-I256 WeakPolarHBondContact O-CG1 3.32Å; S252-I256 PolarHBondContact O-N 3.41Å; E254-I256 VanDerWaalsContact C-N 3.28Å; E254-I256 PolarHBondContact O-N 3.18Å; I256-Y259 PolarHBondContact O-N 3.16Å; I256-I260 HydrophobicContact CG2-CD1 3.83Å; I256-I260 HydrophobicContact CG2-CG1 4.45Å; I256-I260 VanDerWaalsContact O-CG1 3.29Å; I256-I260 WeakPolarHBondContact O-CG1 3.21Å; I256-I260 PolarHBondContact O-N 2.94Å; I256-F359 HydrophobicContact CD1-CE2 4.24Å; I256-F359 HydrophobicContact CD1-CZ 4.11Å; I256-F359 HydrophobicContact CG1-CE2 4.34Å; I256-F359 HydrophobicContact CG1-CZ 3.72Å; I256-M363 HydrophobicContact CG2-CE 3.79Å
257	R	79.6	Confident	71.7	Confident	107 Å²	107	88.2 Å²	88.2	40%	0.404	46%	0.461	S	S	.	.	H	α-helix	trans	-59.7	-50.4	178.4	-172.1	-173.9	-54.8	115.8	5.4	110.6	T253 E254 Y259 I260 E261	T253-R257 VanDerWaalsContact O-CB 3.23Å; T253-R257 WeakPolarHBondContact O-CB 3.12Å; T253-R257 PolarHBondContact O-N 3.39Å; E254-R257 PolarHBondContact O-N 3.49Å; E254-R257 IonicContact OE1-NH1 3.64Å; E254-R257 IonicContact OE2-CZ 2.71Å; E254-R257 IonicContact OE2-NH1 2.72Å; E254-R257 PolarHBondContact OE2-NH1 3.45Å; R257-Y259 VanDerWaalsContact C-N 3.3Å; R257-Y259 PolarHBondContact O-N 2.88Å; R257-I260 PolarHBondContact O-N 3.42Å; R257-I260 VanDerWaalsContact O-N 3.15Å; R257-E261 VanDerWaalsContact CD-OE1 3.26Å; R257-E261 WeakPolarHBondContact CD-OE1 3.08Å; R257-E261 VanDerWaalsContact CG-CD 3.48Å; R257-E261 HydrophobicContact CG-CG 4.17Å; R257-E261 WeakPolarHBondContact CG-OE1 3.49Å; R257-E261 WeakPolarHBondContact O-CB 3.43Å; R257-E261 WeakPolarHBondContact O-CG 3.44Å; R257-E261 PolarHBondContact O-N 3.17Å
258	H	81.5	Confident	73.4	Confident	94 Å²	94	91 Å²	91	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-56.2	-44.2	176.5	178.7	79.1	0	0	0	111.7	E254 E261 N262	E254-H258 VanDerWaalsContact O-CB 3.29Å; E254-H258 WeakPolarHBondContact O-CB 3.35Å; E254-H258 PolarHBondContact O-N 3.15Å; H258-E261 PolarHBondContact O-N 3.45Å; H258-N262 PolarHBondContact CE1-ND2 3.4Å; H258-N262 VanDerWaalsContact CE1-ND2 3.34Å; H258-N262 PolarHBondContact ND1-ND2 2.89Å; H258-N262 VanDerWaalsContact ND1-ND2 3.19Å; H258-N262 WeakPolarHBondContact O-CB 2.95Å; H258-N262 PolarHBondContact O-N 3.49Å; H258-N262 PolarHBondContact O-ND2 3.35Å
259	Y	82.7	Confident	75.1	Confident	39 Å²	39	88.6 Å²	88.6	15%	0.153	45%	0.448	C	S	.	.	H	α-helix	trans	-61.1	-46.5	176.5	179.9	-101.6	0	0	0	112.6	A255 I256 R257 I263 P272 L360 M363 V364	A255-Y259 VanDerWaalsContact O-CB 3.32Å; A255-Y259 WeakPolarHBondContact O-CB 3.43Å; A255-Y259 PolarHBondContact O-N 3.26Å; I256-Y259 PolarHBondContact O-N 3.16Å; R257-Y259 VanDerWaalsContact C-N 3.3Å; R257-Y259 PolarHBondContact O-N 2.88Å; Y259-I263 HydrophobicContact CE1-CD1 4.22Å; Y259-I263 PolarHBondContact O-N 2.97Å; Y259-I263 VanDerWaalsContact O-N 3.09Å; Y259-P272 HydrophobicContact CD2-CB 4.28Å; Y259-P272 HydrophobicContact CE2-CB 3.53Å; Y259-P272 HydrophobicContact CE2-CG 4.49Å; Y259-L360 HydrophobicContact CD2-CD2 4.04Å; Y259-L360 HydrophobicContact CE1-CD2 4.09Å; Y259-L360 HydrophobicContact CE2-CD2 3.41Å; Y259-L360 VanDerWaalsContact CE2-CD2 3.41Å; Y259-L360 VanDerWaalsContact CZ-CD2 3.46Å; Y259-M363 HydrophobicContact CD1-CB 4.37Å; Y259-M363 HydrophobicContact CE1-CB 4.05Å; Y259-V364 HydrophobicContact CE1-CG2 4.28Å; Y259-V364 VanDerWaalsContact OH-CG2 3.25Å; Y259-V364 WeakPolarHBondContact OH-CG2 3.48Å
260	I	83	Confident	77	Confident	47 Å²	47	84.4 Å²	84.4	24%	0.241	43%	0.433	C	S	.	.	H	α-helix	trans	-67.1	-38.2	179.9	-65.5	171	0	0	0	111.5	I256 R257 N262 I263 M363 H367	I256-I260 HydrophobicContact CG2-CD1 3.83Å; I256-I260 HydrophobicContact CG2-CG1 4.45Å; I256-I260 VanDerWaalsContact O-CG1 3.29Å; I256-I260 WeakPolarHBondContact O-CG1 3.21Å; I256-I260 PolarHBondContact O-N 2.94Å; R257-I260 PolarHBondContact O-N 3.42Å; R257-I260 VanDerWaalsContact O-N 3.15Å; I260-N262 VanDerWaalsContact C-N 3.35Å; I260-I263 WeakPolarHBondContact O-CG2 3.08Å; I260-M363 HydrophobicContact CD1-CE 3.39Å; I260-M363 HydrophobicContact CG1-CE 3.77Å; I260-H367 WeakPolarHBondContact CG2-ND1 3.4Å
261	E	84.3	Confident	78.4	Confident	131 Å²	131	79.6 Å²	79.6	61%	0.612	40%	0.399	S	S	*	.	H	α-helix	trans	-74.4	-26	-178	-74.1	174.8	174.6	0	0	112.9	R257 H258	R257-E261 VanDerWaalsContact CD-OE1 3.26Å; R257-E261 WeakPolarHBondContact CD-OE1 3.08Å; R257-E261 VanDerWaalsContact CG-CD 3.48Å; R257-E261 HydrophobicContact CG-CG 4.17Å; R257-E261 WeakPolarHBondContact CG-OE1 3.49Å; R257-E261 WeakPolarHBondContact O-CB 3.43Å; R257-E261 WeakPolarHBondContact O-CG 3.44Å; R257-E261 PolarHBondContact O-N 3.17Å; H258-E261 PolarHBondContact O-N 3.45Å
262	N	85.1	Confident	79.8	Confident	59 Å²	59	74 Å²	74	32%	0.316	38%	0.377	S	S	.	.	S	Bend	trans	-109.8	8.6	-177.2	-59.8	-81.7	0	0	0	113.4	H258 I260 D273	H258-N262 PolarHBondContact CE1-ND2 3.4Å; H258-N262 VanDerWaalsContact CE1-ND2 3.34Å; H258-N262 PolarHBondContact ND1-ND2 2.89Å; H258-N262 VanDerWaalsContact ND1-ND2 3.19Å; H258-N262 WeakPolarHBondContact O-CB 2.95Å; H258-N262 PolarHBondContact O-N 3.49Å; H258-N262 PolarHBondContact O-ND2 3.35Å; I260-N262 VanDerWaalsContact C-N 3.35Å; N262-D273 HydrophobicContact CB-CB 3.79Å
263	I	87.2	Confident	80.6	Confident	16 Å²	16	75 Å²	75	8%	0.082	38%	0.377	C	S	.	.			trans	-77.3	129.5	167.5	-156.7	172.4	0	0	0	109.3	Y259 I260 Y270 V271 V364	Y259-I263 HydrophobicContact CE1-CD1 4.22Å; Y259-I263 PolarHBondContact O-N 2.97Å; Y259-I263 VanDerWaalsContact O-N 3.09Å; I260-I263 WeakPolarHBondContact O-CG2 3.08Å; I263-Y270 HydrophobicContact CD1-CD1 3.98Å; I263-Y270 HydrophobicContact CD1-CG 4.19Å; I263-Y270 HydrophobicContact CG1-CD1 4.09Å; I263-Y270 HydrophobicContact CG2-CD1 4.48Å; I263-V271 WeakPolarHBondContact CA-O 3.2Å; I263-V364 HydrophobicContact CD1-CB 4.25Å; I263-V364 HydrophobicContact CD1-CG1 4.13Å; I263-V364 HydrophobicContact CD1-CG2 3.37Å
264	T	86.1	Confident	80.7	Confident	68 Å²	68	76 Å²	76	42%	0.417	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153.2	178.2	56.6	0	0	0	0	109.9	Y270 V271	T264-Y270 CarbonylContact O-C 3.56Å; T264-Y270 WeakPolarHBondContact O-CA 3.47Å; T264-V271 PolarHBondContact N-O 3.34Å; T264-V271 PolarHBondContact O-N 2.73Å; T264-V271 PolarHBondContact OG1-O 2.98Å
265	F	87.8	Confident	80.6	Confident	95 Å²	95	75.6 Å²	75.6	42%	0.417	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	108.8	173.3	-169.9	-106	0	0	0	109.1	R269 Y270 L415	F265-R269 CarbonylContact C-O 3.5Å; F265-R269 WeakPolarHBondContact CA-O 3.37Å; F265-R269 WeakPolarHBondContact CD2-O 3.4Å; F265-Y270 HydrophobicContact CB-CD1 4.33Å; F265-Y270 HydrophobicContact CB-CE1 4.15Å; F265-Y270 AromaticContact CD2-CD1 3.95Å; F265-Y270 HydrophobicContact CD2-CD1 3.95Å; F265-Y270 AromaticContact CD2-CD2 3.78Å; F265-Y270 HydrophobicContact CD2-CD2 3.78Å; F265-Y270 AromaticContact CD2-CE1 3.87Å; F265-Y270 HydrophobicContact CD2-CE1 3.87Å; F265-Y270 AromaticContact CD2-CE2 3.69Å; F265-Y270 HydrophobicContact CD2-CE2 3.69Å; F265-Y270 AromaticContact CD2-CG 3.91Å; F265-Y270 HydrophobicContact CD2-CG 3.91Å; F265-Y270 AromaticContact CD2-CZ 3.73Å; F265-Y270 HydrophobicContact CE2-CD2 4.03Å; F265-Y270 AromaticContact CE2-CE2 3.9Å; F265-Y270 HydrophobicContact CE2-CE2 3.9Å; F265-Y270 HydrophobicContact CG-CE1 4.41Å; F265-L415 WeakPolarHBondContact CZ-O 3.5Å
266	E	84.4	Confident	80.6	Confident	89 Å²	89	80.3 Å²	80.3	42%	0.416	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.9	-179	-64.6	-179.8	179.5	0	0	108.7	E268 R269 V271	E266-E268 PolarHBondContact O-N 3.26Å; E266-R269 PolarHBondContact N-O 3.35Å; E266-R269 WeakPolarHBondContact O-CG 3.23Å; E266-R269 PolarHBondContact O-N 2.98Å; E266-R269 VanDerWaalsContact O-O 3.04Å; E266-V271 HydrophobicContact CB-CG2 4Å; E266-V271 HydrophobicContact CG-CB 4.28Å; E266-V271 HydrophobicContact CG-CG2 4.09Å
267	V	78.7	Confident	80.7	Confident	134 Å²	134	82.4 Å²	82.4	81%	0.812	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.1	76.8	170.7	-168.5	0	0	0	0	113.1	R269	V267-R269 VanDerWaalsContact C-N 3.25Å; V267-R269 PolarHBondContact O-N 2.69Å
268	E	80.7	Confident	80.8	Confident	156 Å²	156	82.9 Å²	82.9	73%	0.729	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	14.3	177.6	-53.1	-172.7	156.1	0	0	116.1	E266 G417	E266-E268 PolarHBondContact O-N 3.26Å; E268-G417 WeakPolarHBondContact O-CA 3.31Å
269	R	83	Confident	80.9	Confident	105 Å²	105	85.9 Å²	85.9	40%	0.396	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	154.1	176.1	58.9	175.9	-176.9	-175.5	-1.9	113.6	F265 E266 V267 V271	F265-R269 CarbonylContact C-O 3.5Å; F265-R269 WeakPolarHBondContact CA-O 3.37Å; F265-R269 WeakPolarHBondContact CD2-O 3.4Å; E266-R269 PolarHBondContact N-O 3.35Å; E266-R269 WeakPolarHBondContact O-CG 3.23Å; E266-R269 PolarHBondContact O-N 2.98Å; E266-R269 VanDerWaalsContact O-O 3.04Å; V267-R269 VanDerWaalsContact C-N 3.25Å; V267-R269 PolarHBondContact O-N 2.69Å; R269-V271 HydrophobicContact CG-CG2 4.32Å
270	Y	86.1	Confident	81.2	Confident	32 Å²	32	88.5 Å²	88.5	13%	0.125	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	136.5	170.2	-74.7	-82.4	0	0	0	111.9	I263 T264 F265 V364 H367 H368 F418	I263-Y270 HydrophobicContact CD1-CD1 3.98Å; I263-Y270 HydrophobicContact CD1-CG 4.19Å; I263-Y270 HydrophobicContact CG1-CD1 4.09Å; I263-Y270 HydrophobicContact CG2-CD1 4.48Å; T264-Y270 CarbonylContact O-C 3.56Å; T264-Y270 WeakPolarHBondContact O-CA 3.47Å; F265-Y270 HydrophobicContact CB-CD1 4.33Å; F265-Y270 HydrophobicContact CB-CE1 4.15Å; F265-Y270 AromaticContact CD2-CD1 3.95Å; F265-Y270 HydrophobicContact CD2-CD1 3.95Å; F265-Y270 AromaticContact CD2-CD2 3.78Å; F265-Y270 HydrophobicContact CD2-CD2 3.78Å; F265-Y270 AromaticContact CD2-CE1 3.87Å; F265-Y270 HydrophobicContact CD2-CE1 3.87Å; F265-Y270 AromaticContact CD2-CE2 3.69Å; F265-Y270 HydrophobicContact CD2-CE2 3.69Å; F265-Y270 AromaticContact CD2-CG 3.91Å; F265-Y270 HydrophobicContact CD2-CG 3.91Å; F265-Y270 AromaticContact CD2-CZ 3.73Å; F265-Y270 HydrophobicContact CE2-CD2 4.03Å; F265-Y270 AromaticContact CE2-CE2 3.9Å; F265-Y270 HydrophobicContact CE2-CE2 3.9Å; F265-Y270 HydrophobicContact CG-CE1 4.41Å; Y270-V364 HydrophobicContact CD1-CG1 4.15Å; Y270-V364 HydrophobicContact CD2-CG1 3.32Å; Y270-V364 HydrophobicContact CE2-CG1 4.06Å; Y270-V364 HydrophobicContact CG-CG1 3.37Å; Y270-H367 AromaticContact CE1-CD2 3.76Å; Y270-H368 HydrophobicContact CE2-CB 3.86Å; Y270-H368 AromaticContact CE2-CG 3.94Å; Y270-H368 AromaticContact CE2-ND1 3.67Å; Y270-H368 AromaticContact CZ-ND1 3.64Å; Y270-H368 WeakPolarHBondContact OH-CB 3.31Å; Y270-H368 PolarHBondContact OH-ND1 3.47Å; Y270-F418 HydrophobicContact CD2-CE2 4.1Å; Y270-F418 AromaticContact CD2-CZ 3.88Å; Y270-F418 HydrophobicContact CD2-CZ 3.88Å; Y270-F418 AromaticContact CE2-CE2 3.93Å; Y270-F418 HydrophobicContact CE2-CE2 3.93Å; Y270-F418 HydrophobicContact CE2-CZ 4.19Å
271	V	82.3	Confident	81.5	Confident	6 Å²	6	91.4 Å²	91.4	4%	0.036	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	113.2	-174.1	169	0	0	0	0	109	I263 T264 E266 R269 R326	I263-V271 WeakPolarHBondContact CA-O 3.2Å; T264-V271 PolarHBondContact N-O 3.34Å; T264-V271 PolarHBondContact O-N 2.73Å; T264-V271 PolarHBondContact OG1-O 2.98Å; E266-V271 HydrophobicContact CB-CG2 4Å; E266-V271 HydrophobicContact CG-CB 4.28Å; E266-V271 HydrophobicContact CG-CG2 4.09Å; R269-V271 HydrophobicContact CG-CG2 4.32Å; V271-R326 VanDerWaalsContact CG1-NH2 3.28Å
272	P	76.6	Confident	81.9	Confident	47 Å²	47	93.9 Å²	93.9	31%	0.305	49%	0.485	S	S	.	.			trans	-76.7	157.9	174.5	33.9	-35.8	0	0	0	111.2	Y259	Y259-P272 HydrophobicContact CD2-CB 4.28Å; Y259-P272 HydrophobicContact CE2-CB 3.53Å; Y259-P272 HydrophobicContact CE2-CG 4.49Å
273	D	73.7	Confident	82.3	Confident	87 Å²	87	96.6 Å²	96.6	47%	0.465	50%	0.496	S	S	.	.			trans	-58.2	154.8	176.1	-161.9	13	0	0	0	113.1	N262 V275	N262-D273 HydrophobicContact CB-CB 3.79Å; D273-V275 PolarHBondContact O-N 2.92Å; D273-V275 VanDerWaalsContact O-N 3.16Å
274	A	68.6	Low	82.5	Confident	75 Å²	75	97 Å²	97	62%	0.62	50%	0.502	S	S	*	.			trans	-69.9	108.6	-180	0	0	0	0	0	110.7
275	V	70.9	Confident	82.9	Confident	90 Å²	90	95.6 Å²	95.6	55%	0.545	49%	0.491	S	S	.	.			trans	-84.4	124.3	174.1	-172.3	0	0	0	0	109.8	D273 L277	D273-V275 PolarHBondContact O-N 2.92Å; D273-V275 VanDerWaalsContact O-N 3.16Å; V275-L277 HydrophobicContact CB-CG 4.47Å; V275-L277 HydrophobicContact CG1-CD2 3.8Å; V275-L277 HydrophobicContact CG1-CG 3.93Å; V275-L277 PolarHBondContact O-N 2.81Å; V275-L277 VanDerWaalsContact O-N 3.11Å
276	N	73.3	Confident	83.2	Confident	161 Å²	161	92.5 Å²	92.5	86%	0.861	49%	0.487	S	S	*	.			trans	-80.7	90.4	175.4	-167.1	3.7	0	0	0	110.5
277	L	78.9	Confident	83.7	Confident	93 Å²	93	96.3 Å²	96.3	49%	0.487	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-93.8	146.8	177.1	-65.8	-179.9	0	0	0	111.5	V275 K279 V328	V275-L277 HydrophobicContact CB-CG 4.47Å; V275-L277 HydrophobicContact CG1-CD2 3.8Å; V275-L277 HydrophobicContact CG1-CG 3.93Å; V275-L277 PolarHBondContact O-N 2.81Å; V275-L277 VanDerWaalsContact O-N 3.11Å; L277-K279 PolarHBondContact O-N 2.83Å; L277-V328 HydrophobicContact CD1-CG1 3.89Å; L277-V328 HydrophobicContact CG-CG1 4.48Å
278	P	81.9	Confident	84.4	Confident	116 Å²	116	90.2 Å²	90.2	75%	0.753	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-60.3	134.9	175.6	-22.2	32.3	0	0	0	112.7	N280	P278-N280 PolarHBondContact O-N 2.64Å
279	K	84.2	Confident	85	Confident	157 Å²	157	87.8 Å²	87.8	68%	0.683	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-61.9	122.3	174.7	-65.4	-170	177.1	-169	0	110.6	L277 D323	L277-K279 PolarHBondContact O-N 2.83Å; K279-D323 IonicContact NZ-OD1 3.67Å
280	N	87.7	Confident	85.5	Confident	94 Å²	94	88.7 Å²	88.7	50%	0.503	46%	0.456	S	S	.	.			trans	-118.2	28.8	-175.5	68.9	-5.9	0	0	0	113.6	P278 K282 Q283 A284	P278-N280 PolarHBondContact O-N 2.64Å; N280-K282 VanDerWaalsContact C-N 3.3Å; N280-K282 PolarHBondContact O-N 2.66Å; N280-Q283 PolarHBondContact O-N 2.77Å; N280-Q283 PolarHBondContact O-OE1 2.87Å; N280-A284 PolarHBondContact O-N 3.42Å
281	Y	90.1	Very high	85.8	Confident	108 Å²	108	90.3 Å²	90.3	42%	0.424	47%	0.466	S	S	.	.	H	α-helix	trans	-53.7	-43.2	-173.7	-176.8	-86	0	0	0	113	Q283 A284 N285 L332 I344	Y281-Q283 VanDerWaalsContact C-N 3.32Å; Y281-Q283 PolarHBondContact O-N 2.55Å; Y281-A284 PolarHBondContact O-N 2.75Å; Y281-N285 HydrophobicContact CD1-CB 4.47Å; Y281-N285 HydrophobicContact CE1-CB 4.2Å; Y281-N285 WeakPolarHBondContact O-CB 3.45Å; Y281-N285 PolarHBondContact O-N 2.79Å; Y281-L332 HydrophobicContact CD2-CD1 4.24Å; Y281-L332 HydrophobicContact CD2-CD2 4.03Å; Y281-L332 HydrophobicContact CE2-CD1 3.88Å; Y281-L332 HydrophobicContact CE2-CD2 3.51Å; Y281-L332 HydrophobicContact CE2-CG 4.34Å; Y281-I344 HydrophobicContact CE2-CD1 4.2Å; Y281-I344 HydrophobicContact CE2-CG1 4.44Å
282	K	92	Very high	86.3	Confident	184 Å²	184	90.4 Å²	90.4	80%	0.8	47%	0.466	S	S	*	.	H	α-helix	trans	-59.7	-42.1	179.6	-72.1	-173.8	177.9	-179.7	0	112	N280 G286	N280-K282 VanDerWaalsContact C-N 3.3Å; N280-K282 PolarHBondContact O-N 2.66Å; K282-G286 PolarHBondContact O-N 2.81Å; K282-G286 VanDerWaalsContact O-N 3.08Å
283	Q	93.3	Very high	87	Confident	116 Å²	116	97.3 Å²	97.3	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-68.9	-42.1	177.4	-63.1	89.4	-11.2	0	0	111.4	N280 Y281 G286 R287	N280-Q283 PolarHBondContact O-N 2.77Å; N280-Q283 PolarHBondContact O-OE1 2.87Å; Y281-Q283 VanDerWaalsContact C-N 3.32Å; Y281-Q283 PolarHBondContact O-N 2.55Å; Q283-G286 PolarHBondContact O-N 3.22Å; Q283-R287 WeakPolarHBondContact O-CG 3.44Å; Q283-R287 PolarHBondContact O-N 3.13Å
284	A	91.9	Very high	87.9	Confident	24 Å²	24	100.9 Å²	100.9	20%	0.198	50%	0.498	C	S	.	.	H	α-helix	trans	-61.6	-44	177	0	0	0	0	0	111.7	N280 Y281 R287 L288 L332	N280-A284 PolarHBondContact O-N 3.42Å; Y281-A284 PolarHBondContact O-N 2.75Å; A284-R287 WeakPolarHBondContact O-CB 3.39Å; A284-R287 PolarHBondContact O-N 3.41Å; A284-L288 PolarHBondContact O-N 2.88Å; A284-L332 HydrophobicContact CB-CD1 4.04Å; A284-L332 HydrophobicContact CB-CG 4.3Å
285	N	94.1	Very high	89	Confident	38 Å²	38	98 Å²	98	20%	0.203	47%	0.472	C	S	.	.	H	α-helix	trans	-64.1	-43.7	178.3	-162.5	33.6	0	0	0	111.3	Y281 R287 L288 F289 L332	Y281-N285 HydrophobicContact CD1-CB 4.47Å; Y281-N285 HydrophobicContact CE1-CB 4.2Å; Y281-N285 WeakPolarHBondContact O-CB 3.45Å; Y281-N285 PolarHBondContact O-N 2.79Å; N285-R287 VanDerWaalsContact C-N 3.3Å; N285-R287 PolarHBondContact O-N 3.44Å; N285-L288 PolarHBondContact O-N 3.3Å; N285-F289 WeakPolarHBondContact O-CD2 3.35Å; N285-F289 PolarHBondContact O-N 2.93Å; N285-L332 VanDerWaalsContact CA-CD1 3.5Å; N285-L332 HydrophobicContact CB-CD1 3.69Å
286	G	94.9	Very high	89.7	Confident	31 Å²	31	97.9 Å²	97.9	32%	0.32	48%	0.475	S	S	.	.	H	α-helix	trans	-58.4	-39.3	173.1	0	0	0	0	0	113.3	K282 Q283 Q290	K282-G286 PolarHBondContact O-N 2.81Å; K282-G286 VanDerWaalsContact O-N 3.08Å; Q283-G286 PolarHBondContact O-N 3.22Å; G286-Q290 VanDerWaalsContact O-CG 3.29Å; G286-Q290 WeakPolarHBondContact O-CG 3.48Å; G286-Q290 PolarHBondContact O-N 2.84Å; G286-Q290 VanDerWaalsContact O-N 3.16Å
287	R	94	Very high	90.3	Very high	168 Å²	168	94.9 Å²	94.9	63%	0.634	47%	0.472	S	S	*	.	H	α-helix	trans	-67.3	-40.7	175.3	-72.9	174.7	178.2	179.3	-0.3	112.3	Q283 A284 N285 Q290 I291	Q283-R287 WeakPolarHBondContact O-CG 3.44Å; Q283-R287 PolarHBondContact O-N 3.13Å; A284-R287 WeakPolarHBondContact O-CB 3.39Å; A284-R287 PolarHBondContact O-N 3.41Å; N285-R287 VanDerWaalsContact C-N 3.3Å; N285-R287 PolarHBondContact O-N 3.44Å; R287-Q290 PolarHBondContact O-N 2.65Å; R287-I291 WeakPolarHBondContact O-CG1 3.27Å; R287-I291 PolarHBondContact O-N 3.43Å
288	L	95	Very high	90.8	Very high	7 Å²	7	92.2 Å²	92.2	4%	0.037	46%	0.462	C	S	.	.	H	α-helix	trans	-58.8	-51.8	175.4	176.5	62.3	0	0	0	110.6	A284 N285 Q290 I291 E292 L332 P342	A284-L288 PolarHBondContact O-N 2.88Å; N285-L288 PolarHBondContact O-N 3.3Å; L288-Q290 VanDerWaalsContact C-N 3.26Å; L288-Q290 PolarHBondContact O-N 3.5Å; L288-I291 PolarHBondContact O-N 3.47Å; L288-E292 HydrophobicContact CD1-CG 3.93Å; L288-E292 HydrophobicContact CG-CG 4.25Å; L288-E292 WeakPolarHBondContact O-CG 3.31Å; L288-E292 PolarHBondContact O-N 2.86Å; L288-L332 HydrophobicContact CB-CB 4.49Å; L288-L332 HydrophobicContact CD2-CB 3.77Å; L288-P342 HydrophobicContact CD2-CB 3.69Å; L288-P342 HydrophobicContact CD2-CG 4.14Å
289	F	93.1	Very high	91.1	Very high	104 Å²	104	98.6 Å²	98.6	46%	0.456	47%	0.471	S	S	.	.	H	α-helix	trans	-56	-39.9	177.3	-81.6	-68.4	0	0	0	112.9	N285 R293 R334	N285-F289 WeakPolarHBondContact O-CD2 3.35Å; N285-F289 PolarHBondContact O-N 2.93Å; F289-R293 VanDerWaalsContact O-CB 3.31Å; F289-R293 WeakPolarHBondContact O-CB 3.32Å; F289-R293 PolarHBondContact O-N 3.03Å; F289-R334 VanDerWaalsContact CE1-NH2 3.3Å
290	Q	93.2	Very high	91.3	Very high	124 Å²	124	97.3 Å²	97.3	58%	0.579	47%	0.467	S	S	*	.	H	α-helix	trans	-66	-41.5	177.4	-73.2	173.3	7.5	0	0	112.3	G286 R287 L288 K294	G286-Q290 VanDerWaalsContact O-CG 3.29Å; G286-Q290 WeakPolarHBondContact O-CG 3.48Å; G286-Q290 PolarHBondContact O-N 2.84Å; G286-Q290 VanDerWaalsContact O-N 3.16Å; R287-Q290 PolarHBondContact O-N 2.65Å; L288-Q290 VanDerWaalsContact C-N 3.26Å; L288-Q290 PolarHBondContact O-N 3.5Å; Q290-K294 WeakPolarHBondContact O-CB 3.42Å; Q290-K294 PolarHBondContact O-N 3.34Å
291	I	91.6	Very high	91.4	Very high	67 Å²	67	94 Å²	94	34%	0.344	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-48	177.2	-70.6	167.5	0	0	0	110.1	R287 L288 R293 K294 L295 Y304	R287-I291 WeakPolarHBondContact O-CG1 3.27Å; R287-I291 PolarHBondContact O-N 3.43Å; L288-I291 PolarHBondContact O-N 3.47Å; I291-R293 PolarHBondContact O-N 2.68Å; I291-K294 PolarHBondContact O-N 3.03Å; I291-K294 VanDerWaalsContact O-N 3.12Å; I291-L295 HydrophobicContact CG2-CD1 3.55Å; I291-L295 HydrophobicContact CG2-CG 4.14Å; I291-L295 WeakPolarHBondContact O-CB 3.43Å; I291-L295 WeakPolarHBondContact O-CG 3.49Å; I291-L295 PolarHBondContact O-N 3.06Å; I291-Y304 HydrophobicContact CG2-CE1 4.06Å; I291-Y304 HydrophobicContact CG2-CE2 4.31Å
292	E	93.3	Very high	91.4	Very high	8 Å²	8	91.8 Å²	91.8	4%	0.037	45%	0.451	C	S	.	.	H	α-helix	trans	-59.4	-45.8	179.4	-70.6	174.1	155.7	0	0	111.3	L288 K294 L295 S296 R334 M336	L288-E292 HydrophobicContact CD1-CG 3.93Å; L288-E292 HydrophobicContact CG-CG 4.25Å; L288-E292 WeakPolarHBondContact O-CG 3.31Å; L288-E292 PolarHBondContact O-N 2.86Å; E292-K294 VanDerWaalsContact C-N 3.31Å; E292-K294 PolarHBondContact O-N 2.84Å; E292-L295 PolarHBondContact O-N 2.86Å; E292-S296 WeakPolarHBondContact O-CB 3.34Å; E292-S296 PolarHBondContact O-N 2.8Å; E292-S296 PolarHBondContact O-OG 2.72Å; E292-R334 VanDerWaalsContact OE1-CG 3.32Å; E292-R334 WeakPolarHBondContact OE1-CG 3.33Å; E292-R334 IonicContact OE1-CZ 2.63Å; E292-R334 IonicContact OE1-NE 3.46Å; E292-R334 PolarHBondContact OE1-NE 3.45Å; E292-R334 IonicContact OE1-NH2 2.83Å; E292-R334 IonicContact OE2-CZ 2.91Å; E292-R334 IonicContact OE2-NE 2.93Å; E292-R334 PolarHBondContact OE2-NE 2.71Å; E292-R334 IonicContact OE2-NH2 3.74Å; E292-R334 PolarHBondContact OE2-NH2 2.92Å; E292-M336 HydrophobicContact CB-CE 4.32Å; E292-M336 HydrophobicContact CB-SD 4.3Å; E292-M336 HydrophobicContact CG-SD 3.88Å
293	R	91.3	Very high	91.4	Very high	192 Å²	192	87.2 Å²	87.2	73%	0.725	44%	0.438	S	S	*	.	H	α-helix	trans	-62.8	-36.9	176.2	-171.6	-178	69.5	172.5	2	112.6	F289 I291 S296	F289-R293 VanDerWaalsContact O-CB 3.31Å; F289-R293 WeakPolarHBondContact O-CB 3.32Å; F289-R293 PolarHBondContact O-N 3.03Å; I291-R293 PolarHBondContact O-N 2.68Å; R293-S296 PolarHBondContact O-OG 3.31Å
294	K	92.4	Very high	91.3	Very high	161 Å²	161	84 Å²	84	70%	0.7	42%	0.421	S	S	*	.	H	α-helix	trans	-72.4	-41.3	178.7	-174.8	-174.7	175.2	-173.2	0	111.1	Q290 I291 E292	Q290-K294 WeakPolarHBondContact O-CB 3.42Å; Q290-K294 PolarHBondContact O-N 3.34Å; I291-K294 PolarHBondContact O-N 3.03Å; I291-K294 VanDerWaalsContact O-N 3.12Å; E292-K294 VanDerWaalsContact C-N 3.31Å; E292-K294 PolarHBondContact O-N 2.84Å
295	L	91.8	Very high	91.2	Very high	16 Å²	16	85.1 Å²	85.1	8%	0.084	42%	0.423	C	S	.	.	H	α-helix	trans	-78.7	-33.9	-175.7	-71.6	178.2	0	0	0	112.4	I291 E292 A297 S298 Q300 T301 Y304 M336	I291-L295 HydrophobicContact CG2-CD1 3.55Å; I291-L295 HydrophobicContact CG2-CG 4.14Å; I291-L295 WeakPolarHBondContact O-CB 3.43Å; I291-L295 WeakPolarHBondContact O-CG 3.49Å; I291-L295 PolarHBondContact O-N 3.06Å; E292-L295 PolarHBondContact O-N 2.86Å; L295-A297 PolarHBondContact O-N 3.37Å; L295-S298 WeakPolarHBondContact CD2-OG 3.44Å; L295-S298 WeakPolarHBondContact O-CA 3.34Å; L295-S298 WeakPolarHBondContact O-CB 3.35Å; L295-S298 PolarHBondContact O-N 2.76Å; L295-S298 PolarHBondContact O-OG 3.16Å; L295-Q300 HydrophobicContact CD2-CB 4.07Å; L295-T301 PolarHBondContact O-OG1 2.93Å; L295-Y304 HydrophobicContact CD1-CD1 3.25Å; L295-Y304 HydrophobicContact CD1-CD2 3.96Å; L295-Y304 HydrophobicContact CD1-CE1 3.61Å; L295-Y304 HydrophobicContact CD1-CE2 4.31Å; L295-Y304 HydrophobicContact CD1-CG 3.41Å; L295-Y304 VanDerWaalsContact CD1-CG 3.41Å; L295-M336 HydrophobicContact CB-CE 3.97Å
296	S	86.5	Confident	91.2	Very high	87 Å²	87	88.6 Å²	88.6	61%	0.608	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.5	179.9	63.3	0	0	0	0	113.7	E292 R293	E292-S296 WeakPolarHBondContact O-CB 3.34Å; E292-S296 PolarHBondContact O-N 2.8Å; E292-S296 PolarHBondContact O-OG 2.72Å; R293-S296 PolarHBondContact O-OG 3.31Å
297	A	84.2	Confident	91	Very high	97 Å²	97	88.9 Å²	88.9	80%	0.802	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	1.8	175.1	0	0	0	0	0	114.5	L295	L295-A297 PolarHBondContact O-N 3.37Å
298	S	89.7	Confident	90.8	Very high	38 Å²	38	82.1 Å²	82.1	27%	0.266	41%	0.414	S	S	.	.	S	Bend	trans	-113.3	154.1	-169.7	91.8	0	0	0	0	112.6	L295 Q300 T301	L295-S298 WeakPolarHBondContact CD2-OG 3.44Å; L295-S298 WeakPolarHBondContact O-CA 3.34Å; L295-S298 WeakPolarHBondContact O-CB 3.35Å; L295-S298 PolarHBondContact O-N 2.76Å; L295-S298 PolarHBondContact O-OG 3.16Å; S298-Q300 PolarHBondContact O-N 3.39Å; S298-Q300 PolarHBondContact OG-N 3.22Å; S298-Q300 VanDerWaalsContact OG-N 3.09Å; S298-T301 PolarHBondContact O-OG1 3.32Å
299	R	88.1	Confident	90.6	Very high	249 Å²	249	85.5 Å²	85.5	94%	0.94	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-9	169.4	-65.4	-179.6	-179	157	-0.2	113.4	T301	R299-T301 VanDerWaalsContact C-N 3.31Å
300	Q	89.5	Confident	90.5	Very high	130 Å²	130	82.5 Å²	82.5	61%	0.607	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.5	-175.4	-66.1	177.8	-23.1	0	0	113.2	L295 S298 S302 T303 Y304	L295-Q300 HydrophobicContact CD2-CB 4.07Å; S298-Q300 PolarHBondContact O-N 3.39Å; S298-Q300 PolarHBondContact OG-N 3.22Å; S298-Q300 VanDerWaalsContact OG-N 3.09Å; Q300-S302 PolarHBondContact O-N 2.92Å; Q300-T303 PolarHBondContact O-N 2.99Å; Q300-Y304 WeakPolarHBondContact O-CB 3.35Å; Q300-Y304 PolarHBondContact O-N 3.49Å
301	T	90.5	Very high	90.4	Very high	26 Å²	26	80.3 Å²	80.3	16%	0.16	41%	0.413	C	S	.	.	H	α-helix	trans	-58.4	-45.1	-178.7	-51	0	0	0	0	112.4	L295 S298 R299 T303 Y304 M305 M336	L295-T301 PolarHBondContact O-OG1 2.93Å; S298-T301 PolarHBondContact O-OG1 3.32Å; R299-T301 VanDerWaalsContact C-N 3.31Å; T301-T303 PolarHBondContact O-N 2.9Å; T301-Y304 PolarHBondContact O-N 2.69Å; T301-M305 HydrophobicContact CG2-CE 3.97Å; T301-M305 HydrophobicContact CG2-SD 4.18Å; T301-M305 WeakPolarHBondContact O-CG 3.35Å; T301-M305 PolarHBondContact O-N 3.45Å; T301-M336 HydrophobicContact CG2-CE 3.89Å; T301-M336 HydrophobicContact CG2-CG 3.92Å; T301-M336 HydrophobicContact CG2-SD 4.42Å
302	S	89.8	Confident	90.3	Very high	60 Å²	60	80.2 Å²	80.2	42%	0.42	41%	0.412	S	S	.	.	H	α-helix	trans	-59.1	-50	177.6	-157.7	0	0	0	0	110.8	Q300 Y304 M305 E306	Q300-S302 PolarHBondContact O-N 2.92Å; S302-Y304 VanDerWaalsContact C-N 3.29Å; S302-Y304 PolarHBondContact O-N 3.23Å; S302-M305 PolarHBondContact O-N 3.08Å; S302-E306 WeakPolarHBondContact O-CB 3.44Å; S302-E306 VanDerWaalsContact O-CG 3.25Å; S302-E306 WeakPolarHBondContact O-CG 3.35Å; S302-E306 PolarHBondContact O-N 2.7Å; S302-E306 PolarHBondContact OG-OE1 2.83Å
303	T	91.4	Very high	90.3	Very high	88 Å²	88	84.6 Å²	84.6	54%	0.54	44%	0.444	S	S	.	.	H	α-helix	trans	-60.2	-37.8	178.9	-48.6	0	0	0	0	112.6	Q300 T301 A307	Q300-T303 PolarHBondContact O-N 2.99Å; T301-T303 PolarHBondContact O-N 2.9Å; T303-A307 VanDerWaalsContact O-CB 3.28Å; T303-A307 WeakPolarHBondContact O-CB 3.21Å; T303-A307 PolarHBondContact O-N 2.84Å
304	Y	90.2	Very high	90.2	Very high	49 Å²	49	78.8 Å²	78.8	19%	0.192	43%	0.43	C	S	.	.	H	α-helix	trans	-67.7	-43.1	176.8	177.2	-113.1	0	0	0	112.3	I291 L295 Q300 T301 S302 M308 W333 M336	I291-Y304 HydrophobicContact CG2-CE1 4.06Å; I291-Y304 HydrophobicContact CG2-CE2 4.31Å; L295-Y304 HydrophobicContact CD1-CD1 3.25Å; L295-Y304 HydrophobicContact CD1-CD2 3.96Å; L295-Y304 HydrophobicContact CD1-CE1 3.61Å; L295-Y304 HydrophobicContact CD1-CE2 4.31Å; L295-Y304 HydrophobicContact CD1-CG 3.41Å; L295-Y304 VanDerWaalsContact CD1-CG 3.41Å; Q300-Y304 WeakPolarHBondContact O-CB 3.35Å; Q300-Y304 PolarHBondContact O-N 3.49Å; T301-Y304 PolarHBondContact O-N 2.69Å; S302-Y304 VanDerWaalsContact C-N 3.29Å; S302-Y304 PolarHBondContact O-N 3.23Å; Y304-M308 HydrophobicContact CD2-CE 4.43Å; Y304-M308 HydrophobicContact CE2-CE 3.61Å; Y304-M308 VanDerWaalsContact O-CG 3.31Å; Y304-M308 WeakPolarHBondContact O-CG 3.34Å; Y304-M308 PolarHBondContact O-N 3.18Å; Y304-W333 AromaticContact CD1-CH2 3.68Å; Y304-W333 HydrophobicContact CD1-CH2 3.68Å; Y304-W333 AromaticContact CD1-CZ3 3.78Å; Y304-W333 HydrophobicContact CD1-CZ3 3.78Å; Y304-W333 HydrophobicContact CE1-CE3 4.23Å; Y304-W333 AromaticContact CE1-CH2 3.5Å; Y304-W333 HydrophobicContact CE1-CH2 3.5Å; Y304-W333 AromaticContact CE1-CZ3 3.1Å; Y304-W333 HydrophobicContact CE1-CZ3 3.1Å; Y304-W333 HydrophobicContact CE2-CZ3 4.2Å; Y304-W333 HydrophobicContact CG-CH2 4.49Å; Y304-W333 AromaticContact CZ-CZ3 3.35Å; Y304-W333 WeakPolarHBondContact OH-CZ3 3.43Å; Y304-M336 HydrophobicContact CD1-SD 4.38Å; Y304-M336 HydrophobicContact CE1-SD 4.3Å
305	M	91.3	Very high	89.9	Confident	48 Å²	48	72.8 Å²	72.8	24%	0.236	41%	0.414	C	S	.	.	H	α-helix	trans	-65.4	-48.5	175.9	-66.6	-179.1	-54.8	0	0	110.9	T301 S302 A307 M308 D309 W333 N335 M336	T301-M305 HydrophobicContact CG2-CE 3.97Å; T301-M305 HydrophobicContact CG2-SD 4.18Å; T301-M305 WeakPolarHBondContact O-CG 3.35Å; T301-M305 PolarHBondContact O-N 3.45Å; S302-M305 PolarHBondContact O-N 3.08Å; M305-A307 VanDerWaalsContact C-N 3.31Å; M305-A307 PolarHBondContact O-N 3.06Å; M305-M308 PolarHBondContact O-N 2.78Å; M305-M308 VanDerWaalsContact O-N 3.08Å; M305-D309 PolarHBondContact O-N 3.03Å; M305-W333 HydrophobicContact CG-CH2 4.31Å; M305-W333 HydrophobicContact CG-CZ2 4.39Å; M305-N335 WeakPolarHBondContact CG-OD1 3.21Å; M305-N335 PolarHBondContact SD-OD1 2.7Å; M305-M336 HydrophobicContact CG-CG 4.01Å; M305-M336 HydrophobicContact SD-CB 4.17Å; M305-M336 HydrophobicContact SD-CG 3.84Å
306	E	92.6	Very high	89.7	Confident	111 Å²	111	76.8 Å²	76.8	52%	0.519	43%	0.428	S	S	.	.	H	α-helix	trans	-56.6	-41.9	176.7	-73.1	162	-146.9	0	0	112.3	S302 M308 A310	S302-E306 WeakPolarHBondContact O-CB 3.44Å; S302-E306 VanDerWaalsContact O-CG 3.25Å; S302-E306 WeakPolarHBondContact O-CG 3.35Å; S302-E306 PolarHBondContact O-N 2.7Å; S302-E306 PolarHBondContact OG-OE1 2.83Å; E306-M308 VanDerWaalsContact C-N 3.34Å; E306-M308 PolarHBondContact O-N 3.25Å; E306-A310 VanDerWaalsContact O-CB 3.25Å; E306-A310 WeakPolarHBondContact O-CB 3.15Å; E306-A310 PolarHBondContact O-N 2.87Å
307	A	90.8	Very high	89.8	Confident	37 Å²	37	72.9 Å²	72.9	31%	0.306	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-38.4	177.6	0	0	0	0	0	112.4	T303 M305 A310 Y311	T303-A307 VanDerWaalsContact O-CB 3.28Å; T303-A307 WeakPolarHBondContact O-CB 3.21Å; T303-A307 PolarHBondContact O-N 2.84Å; M305-A307 VanDerWaalsContact C-N 3.31Å; M305-A307 PolarHBondContact O-N 3.06Å; A307-A310 PolarHBondContact O-N 3.34Å; A307-Y311 WeakPolarHBondContact O-CD2 3.5Å; A307-Y311 VanDerWaalsContact O-CG 3.28Å; A307-Y311 PolarHBondContact O-N 2.78Å; A307-Y311 VanDerWaalsContact O-N 3.08Å
308	M	90.5	Very high	90	Very high	26 Å²	26	71.9 Å²	71.9	13%	0.128	38%	0.379	C	S	.	.	H	α-helix	trans	-73.8	-40.5	179.6	-69.5	-77.2	-169.5	0	0	111.5	Y304 M305 E306 A310 Y311 I312 Y331 W333	Y304-M308 HydrophobicContact CD2-CE 4.43Å; Y304-M308 HydrophobicContact CE2-CE 3.61Å; Y304-M308 VanDerWaalsContact O-CG 3.31Å; Y304-M308 WeakPolarHBondContact O-CG 3.34Å; Y304-M308 PolarHBondContact O-N 3.18Å; M305-M308 PolarHBondContact O-N 2.78Å; M305-M308 VanDerWaalsContact O-N 3.08Å; E306-M308 VanDerWaalsContact C-N 3.34Å; E306-M308 PolarHBondContact O-N 3.25Å; M308-A310 VanDerWaalsContact C-N 3.28Å; M308-A310 PolarHBondContact O-N 3.09Å; M308-Y311 PolarHBondContact O-N 3.12Å; M308-Y311 VanDerWaalsContact O-N 3.16Å; M308-Y311 HydrophobicContact SD-CD2 4.05Å; M308-Y311 HydrophobicContact SD-CE2 4.41Å; M308-I312 WeakPolarHBondContact O-CG1 3.38Å; M308-I312 PolarHBondContact O-N 3.24Å; M308-I312 VanDerWaalsContact O-N 3.12Å; M308-Y331 HydrophobicContact CE-CE2 4.3Å; M308-Y331 HydrophobicContact SD-CE2 3.72Å; M308-W333 HydrophobicContact CB-CD2 4.31Å; M308-W333 HydrophobicContact CB-CE3 4.35Å; M308-W333 HydrophobicContact CB-CH2 3.63Å; M308-W333 HydrophobicContact CB-CZ2 3.58Å; M308-W333 HydrophobicContact CB-CZ3 3.97Å; M308-W333 HydrophobicContact CE-CE3 4.29Å; M308-W333 HydrophobicContact CE-CZ3 4.08Å; M308-W333 HydrophobicContact CG-CD2 4.38Å; M308-W333 HydrophobicContact CG-CE3 3.93Å; M308-W333 HydrophobicContact CG-CH2 3.49Å; M308-W333 VanDerWaalsContact CG-CH2 3.49Å; M308-W333 HydrophobicContact CG-CZ2 3.98Å; M308-W333 HydrophobicContact CG-CZ3 3.41Å; M308-W333 VanDerWaalsContact CG-CZ3 3.41Å; M308-W333 HydrophobicContact SD-CE3 4.23Å; M308-W333 HydrophobicContact SD-CZ3 4.19Å
309	D	91.1	Very high	90	Very high	77 Å²	77	75.1 Å²	75.1	41%	0.412	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-36.5	172.5	-69.9	-23	0	0	0	111.3	M305 I312 S313	M305-D309 PolarHBondContact O-N 3.03Å; D309-I312 PolarHBondContact O-N 2.9Å; D309-S313 WeakPolarHBondContact O-CB 3.45Å; D309-S313 PolarHBondContact O-N 2.8Å; D309-S313 PolarHBondContact O-OG 3.04Å
310	A	91.6	Very high	89.9	Confident	41 Å²	41	64.3 Å²	64.3	34%	0.339	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-41.3	172.5	0	0	0	0	0	111.8	E306 A307 M308 I312 S313 T314	E306-A310 VanDerWaalsContact O-CB 3.25Å; E306-A310 WeakPolarHBondContact O-CB 3.15Å; E306-A310 PolarHBondContact O-N 2.87Å; A307-A310 PolarHBondContact O-N 3.34Å; M308-A310 VanDerWaalsContact C-N 3.28Å; M308-A310 PolarHBondContact O-N 3.09Å; A310-I312 VanDerWaalsContact C-N 3.34Å; A310-I312 PolarHBondContact O-N 3.28Å; A310-S313 WeakPolarHBondContact CA-OG 3.26Å; A310-S313 PolarHBondContact O-OG 3.5Å; A310-T314 VanDerWaalsContact O-CB 3.3Å; A310-T314 WeakPolarHBondContact O-CB 3.33Å; A310-T314 WeakPolarHBondContact O-CG2 3.41Å; A310-T314 PolarHBondContact O-N 3.04Å; A310-T314 PolarHBondContact O-OG1 3.32Å
311	Y	90.7	Very high	89.4	Confident	78 Å²	78	63.7 Å²	63.7	31%	0.306	35%	0.353	S	S	.	.	H	α-helix	trans	-64.7	-37.2	176.6	-63.7	-29.9	0	0	0	113.2	A307 M308 T314 G315 W316 V317 F347	A307-Y311 WeakPolarHBondContact O-CD2 3.5Å; A307-Y311 VanDerWaalsContact O-CG 3.28Å; A307-Y311 PolarHBondContact O-N 2.78Å; A307-Y311 VanDerWaalsContact O-N 3.08Å; M308-Y311 PolarHBondContact O-N 3.12Å; M308-Y311 VanDerWaalsContact O-N 3.16Å; M308-Y311 HydrophobicContact SD-CD2 4.05Å; M308-Y311 HydrophobicContact SD-CE2 4.41Å; Y311-T314 PolarHBondContact O-OG1 2.91Å; Y311-G315 PolarHBondContact O-N 3.25Å; Y311-W316 AromaticContact CD1-CE3 3.53Å; Y311-W316 HydrophobicContact CD1-CE3 3.53Å; Y311-W316 AromaticContact CD1-CZ3 3.96Å; Y311-W316 HydrophobicContact CD1-CZ3 3.96Å; Y311-W316 AromaticContact CE1-CE3 3.83Å; Y311-W316 HydrophobicContact CE1-CE3 3.83Å; Y311-W316 AromaticContact CE1-CZ3 3.85Å; Y311-W316 HydrophobicContact CE1-CZ3 3.85Å; Y311-W316 PolarHBondContact O-N 3.13Å; Y311-V317 PolarHBondContact O-N 2.88Å; Y311-V317 VanDerWaalsContact O-N 3.15Å; Y311-F347 HydrophobicContact CD2-CE1 4.14Å; Y311-F347 HydrophobicContact CD2-CZ 4.16Å; Y311-F347 HydrophobicContact CE2-CE1 4.4Å; Y311-F347 HydrophobicContact CE2-CZ 4.27Å; Y311-F347 HydrophobicContact CG-CE1 4.37Å
312	I	90.1	Very high	88.2	Confident	65 Å²	65	70.7 Å²	70.7	33%	0.333	38%	0.377	S	S	.	.	H	α-helix	trans	-71.1	-49.9	176.8	-63.7	167.7	0	0	0	109.9	M308 D309 A310 T314 G315 V317 F345	M308-I312 WeakPolarHBondContact O-CG1 3.38Å; M308-I312 PolarHBondContact O-N 3.24Å; M308-I312 VanDerWaalsContact O-N 3.12Å; D309-I312 PolarHBondContact O-N 2.9Å; A310-I312 VanDerWaalsContact C-N 3.34Å; A310-I312 PolarHBondContact O-N 3.28Å; I312-T314 VanDerWaalsContact C-N 3.34Å; I312-T314 PolarHBondContact O-N 2.89Å; I312-G315 PolarHBondContact O-N 3.39Å; I312-V317 HydrophobicContact CG1-CG1 4.38Å; I312-F345 HydrophobicContact CD1-CD1 4.38Å; I312-F345 HydrophobicContact CD1-CE1 3.91Å; I312-F345 HydrophobicContact CG1-CE1 4.46Å
313	S	92.2	Very high	86.9	Confident	100 Å²	100	73.6 Å²	73.6	70%	0.699	39%	0.388	S	S	*	.	H	α-helix	trans	-66.4	-30.6	-177.5	57.2	0	0	0	0	114	D309 A310 G315	D309-S313 WeakPolarHBondContact O-CB 3.45Å; D309-S313 PolarHBondContact O-N 2.8Å; D309-S313 PolarHBondContact O-OG 3.04Å; A310-S313 WeakPolarHBondContact CA-OG 3.26Å; A310-S313 PolarHBondContact O-OG 3.5Å; S313-G315 PolarHBondContact O-N 3.38Å
314	T	88.4	Confident	85.4	Confident	70 Å²	70	77.4 Å²	77.4	43%	0.429	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-5.4	172.9	55.9	0	0	0	0	113.6	A310 Y311 I312 W316	A310-T314 VanDerWaalsContact O-CB 3.3Å; A310-T314 WeakPolarHBondContact O-CB 3.33Å; A310-T314 WeakPolarHBondContact O-CG2 3.41Å; A310-T314 PolarHBondContact O-N 3.04Å; A310-T314 PolarHBondContact O-OG1 3.32Å; Y311-T314 PolarHBondContact O-OG1 2.91Å; I312-T314 VanDerWaalsContact C-N 3.34Å; I312-T314 PolarHBondContact O-N 2.89Å; T314-W316 VanDerWaalsContact C-N 3.3Å; T314-W316 PolarHBondContact O-N 2.89Å
315	G	87.4	Confident	83.6	Confident	35 Å²	35	78.1 Å²	78.1	36%	0.361	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	27.2	-176.4	0	0	0	0	0	113.1	Y311 I312 S313 I348	Y311-G315 PolarHBondContact O-N 3.25Å; I312-G315 PolarHBondContact O-N 3.39Å; S313-G315 PolarHBondContact O-N 3.38Å; G315-I348 WeakPolarHBondContact O-CD1 3.37Å; G315-I348 WeakPolarHBondContact O-CG1 3.49Å
316	W	86.3	Confident	82.2	Confident	100 Å²	100	80.1 Å²	80.1	38%	0.379	42%	0.417	S	S	.	.	S	Bend	trans	-84.9	-20.5	174	-64.5	2.8	0	0	0	112.2	Y311 T314 F347 I348 R349	Y311-W316 AromaticContact CD1-CE3 3.53Å; Y311-W316 HydrophobicContact CD1-CE3 3.53Å; Y311-W316 AromaticContact CD1-CZ3 3.96Å; Y311-W316 HydrophobicContact CD1-CZ3 3.96Å; Y311-W316 AromaticContact CE1-CE3 3.83Å; Y311-W316 HydrophobicContact CE1-CE3 3.83Å; Y311-W316 AromaticContact CE1-CZ3 3.85Å; Y311-W316 HydrophobicContact CE1-CZ3 3.85Å; Y311-W316 PolarHBondContact O-N 3.13Å; T314-W316 VanDerWaalsContact C-N 3.3Å; T314-W316 PolarHBondContact O-N 2.89Å; W316-F347 WeakPolarHBondContact O-CA 3.27Å; W316-I348 WeakPolarHBondContact O-CG1 3.43Å; W316-I348 PolarHBondContact O-N 3.48Å; W316-R349 VanDerWaalsContact CD1-CZ 3.47Å; W316-R349 VanDerWaalsContact NE1-NH1 3.13Å
317	V	89.5	Confident	81	Confident	5 Å²	5	77.7 Å²	77.7	3%	0.03	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	144.8	176.7	169.6	0	0	0	0	109.4	Y311 I312 Y331 F345 R346 F347	Y311-V317 PolarHBondContact O-N 2.88Å; Y311-V317 VanDerWaalsContact O-N 3.15Å; I312-V317 HydrophobicContact CG1-CG1 4.38Å; V317-Y331 HydrophobicContact CB-CE1 4.4Å; V317-Y331 HydrophobicContact CG1-CE1 3.65Å; V317-Y331 WeakPolarHBondContact CG1-OH 3.43Å; V317-Y331 HydrophobicContact CG2-CE1 3.83Å; V317-F345 HydrophobicContact CG1-CB 3.7Å; V317-F345 HydrophobicContact CG1-CD1 3.8Å; V317-F345 HydrophobicContact CG1-CG 4.2Å; V317-R346 VanDerWaalsContact CA-O 3.25Å; V317-R346 WeakPolarHBondContact CA-O 3.21Å; V317-R346 WeakPolarHBondContact CG1-O 3.35Å; V317-F347 HydrophobicContact CG2-CD1 3.52Å; V317-F347 HydrophobicContact CG2-CD2 4.37Å; V317-F347 HydrophobicContact CG2-CE1 3.56Å; V317-F347 HydrophobicContact CG2-CE2 4.39Å; V317-F347 HydrophobicContact CG2-CG 3.96Å; V317-F347 HydrophobicContact CG2-CZ 4.02Å
318	E	89	Confident	80.5	Confident	77 Å²	77	78.5 Å²	78.5	36%	0.36	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156.6	168.1	67.6	-169.2	177.7	0	0	111.4	F345 R346 I348	E318-F345 CarbonylContact O-C 3.57Å; E318-F345 VanDerWaalsContact O-CA 3.32Å; E318-F345 WeakPolarHBondContact O-CA 3.28Å; E318-R346 HydrophobicContact CG-CG 3.94Å; E318-R346 PolarHBondContact N-O 3.46Å; E318-R346 VanDerWaalsContact N-O 3.12Å; E318-R346 PolarHBondContact O-N 3.36Å; E318-R346 IonicContact OE1-CZ 3.35Å; E318-R346 IonicContact OE1-NE 2.99Å; E318-R346 PolarHBondContact OE1-NE 2.93Å; E318-R346 IonicContact OE1-NH2 2.8Å; E318-R346 PolarHBondContact OE1-NH2 3.42Å; E318-I348 HydrophobicContact CG-CG2 3.84Å
319	E	89.5	Confident	80.2	Confident	105 Å²	105	79.8 Å²	79.8	49%	0.491	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	134.1	171	-170.7	169.4	-160.7	0	0	110.1	N321 F345	E319-N321 PolarHBondContact O-N 2.88Å; E319-F345 HydrophobicContact CB-CD1 4.09Å; E319-F345 HydrophobicContact CB-CE1 3.83Å; E319-F345 HydrophobicContact CB-CZ 4.35Å; E319-F345 HydrophobicContact CG-CE1 4.24Å; E319-F345 HydrophobicContact CG-CZ 4.28Å
320	V	86.5	Confident	80	Confident	23 Å²	23	79 Å²	79	14%	0.139	41%	0.41	C	S	.	.			trans	-85.9	106.9	-177.7	-177.7	0	0	0	0	109.1	I344 R346	V320-I344 HydrophobicContact CB-CB 4.4Å; V320-I344 HydrophobicContact CB-CG2 4.14Å; V320-I344 HydrophobicContact CG2-CG2 4.15Å; V320-I344 PolarHBondContact N-O 3.04Å; V320-R346 HydrophobicContact CG2-CB 3.93Å; V320-R346 HydrophobicContact CG2-CG 3.79Å
321	N	77.4	Confident	79.9	Confident	117 Å²	117	78.7 Å²	78.7	63%	0.626	40%	0.4	S	S	*	.			trans	-93.5	-18.5	-178.8	-69.8	-38.8	0	0	0	114.1	E319	E319-N321 PolarHBondContact O-N 2.88Å
322	Y	66.5	Low	80	Confident	173 Å²	173	75.6 Å²	75.6	68%	0.678	39%	0.388	S	S	*	.			trans	-139.1	147.1	-174.8	-62.6	-79.9	0	0	0	112.9	N324	Y322-N324 VanDerWaalsContact C-N 3.33Å; Y322-N324 PolarHBondContact O-N 3.13Å
323	D	62.8	Low	80.2	Confident	120 Å²	120	73.1 Å²	73.1	64%	0.642	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-16.2	-177.9	-99.7	-27.4	0	0	0	114.1	K279 D325	K279-D323 IonicContact NZ-OD1 3.67Å; D323-D325 PolarHBondContact O-N 2.59Å
324	N	58.9	Low	80.2	Confident	169 Å²	169	69.2 Å²	69.2	90%	0.904	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	13.3	-175.4	-71.5	-18	0	0	0	114.5	Y322	Y322-N324 VanDerWaalsContact C-N 3.33Å; Y322-N324 PolarHBondContact O-N 3.13Å
325	D	53.5	Low	80.4	Confident	63 Å²	63	69.5 Å²	69.5	34%	0.337	34%	0.344	S	S	.	.	S	Bend	trans	-112.3	141	-163	-125.3	-33.9	0	0	0	110	D323 D327 R330 R346	D323-D325 PolarHBondContact O-N 2.59Å; D325-D327 PolarHBondContact O-N 3.1Å; D325-D327 VanDerWaalsContact O-N 3.1Å; D325-R330 PolarHBondContact O-NH2 3.36Å; D325-R346 IonicContact OD1-CZ 2.89Å; D325-R346 IonicContact OD1-NH1 3.73Å; D325-R346 PolarHBondContact OD1-NH1 2.84Å; D325-R346 IonicContact OD1-NH2 2.7Å; D325-R346 PolarHBondContact OD1-NH2 3.02Å; D325-R346 IonicContact OD2-CZ 2.59Å; D325-R346 IonicContact OD2-NH1 3.53Å; D325-R346 IonicContact OD2-NH2 3.99Å; D325-R346 PolarHBondContact OD2-NH2 3.35Å
326	R	60.7	Low	80.5	Confident	91 Å²	91	69.6 Å²	69.6	34%	0.343	34%	0.335	S	S	.	.			trans	-32	115.3	-178.3	-89.2	-165.1	-89	177.2	-11.7	112.5	V271 V328 R346	V271-R326 VanDerWaalsContact CG1-NH2 3.28Å; R326-V328 PolarHBondContact O-N 2.98Å; R326-R346 PolarHBondContact O-NH1 3.01Å; R326-R346 VanDerWaalsContact O-NH1 3.13Å
327	D	68.5	Low	80.8	Confident	60 Å²	60	68 Å²	68	32%	0.321	33%	0.334	S	S	.	.			trans	-101.8	46.7	-165.8	-162.8	3.5	0	0	0	112.9	D325 R330	D325-D327 PolarHBondContact O-N 3.1Å; D325-D327 VanDerWaalsContact O-N 3.1Å; D327-R330 WeakPolarHBondContact OD1-CD 3.25Å; D327-R330 IonicContact OD1-CZ 3.98Å; D327-R330 IonicContact OD1-NE 3.98Å; D327-R330 PolarHBondContact OD1-NE 3.33Å; D327-R330 IonicContact OD1-NH1 3.34Å; D327-R330 PolarHBondContact OD1-NH1 3.16Å; D327-R330 IonicContact OD1-NH2 3.97Å; D327-R330 PolarHBondContact OD1-NH2 2.66Å; D327-R330 IonicContact OD2-NH1 3.93Å
328	V	79.1	Confident	80.7	Confident	53 Å²	53	71.7 Å²	71.7	32%	0.321	36%	0.357	S	S	.	.	S	Bend	trans	-129.2	158.6	176.3	-59.7	0	0	0	0	111.3	L277 R326 R330	L277-V328 HydrophobicContact CD1-CG1 3.89Å; L277-V328 HydrophobicContact CG-CG1 4.48Å; R326-V328 PolarHBondContact O-N 2.98Å; V328-R330 PolarHBondContact O-N 3.39Å; V328-R330 VanDerWaalsContact O-N 3.16Å
329	T	84.4	Confident	80.9	Confident	54 Å²	54	75 Å²	75	33%	0.331	38%	0.377	S	S	.	.	S	Bend	trans	54.9	31.7	178.9	56.4	0	0	0	0	114.8	F347 L354	T329-F347 PolarHBondContact O-N 2.78Å; T329-L354 HydrophobicContact CG2-CD1 3.91Å
330	R	87.6	Confident	81	Confident	61 Å²	61	73.9 Å²	73.9	23%	0.23	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	148.1	173.6	-65.4	-176.6	179.3	177.1	0.9	111.7	D325 D327 V328 I344 F345 R346	D325-R330 PolarHBondContact O-NH2 3.36Å; D327-R330 WeakPolarHBondContact OD1-CD 3.25Å; D327-R330 IonicContact OD1-CZ 3.98Å; D327-R330 IonicContact OD1-NE 3.98Å; D327-R330 PolarHBondContact OD1-NE 3.33Å; D327-R330 IonicContact OD1-NH1 3.34Å; D327-R330 PolarHBondContact OD1-NH1 3.16Å; D327-R330 IonicContact OD1-NH2 3.97Å; D327-R330 PolarHBondContact OD1-NH2 2.66Å; D327-R330 IonicContact OD2-NH1 3.93Å; V328-R330 PolarHBondContact O-N 3.39Å; V328-R330 VanDerWaalsContact O-N 3.16Å; R330-I344 HydrophobicContact CB-CG2 4.35Å; R330-I344 HydrophobicContact CG-CG2 4.44Å; R330-F345 CarbonylContact C-O 3.59Å; R330-F345 WeakPolarHBondContact CA-O 3.31Å; R330-R346 HydrophobicContact CG-CB 4.08Å
331	Y	89	Confident	81.3	Confident	33 Å²	33	78 Å²	78	13%	0.129	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	162	172.5	73.5	-84.8	0	0	0	111.3	M308 V317 W333 F345 F347	M308-Y331 HydrophobicContact CE-CE2 4.3Å; M308-Y331 HydrophobicContact SD-CE2 3.72Å; V317-Y331 HydrophobicContact CB-CE1 4.4Å; V317-Y331 HydrophobicContact CG1-CE1 3.65Å; V317-Y331 WeakPolarHBondContact CG1-OH 3.43Å; V317-Y331 HydrophobicContact CG2-CE1 3.83Å; Y331-W333 HydrophobicContact CD2-CB 4.12Å; Y331-W333 HydrophobicContact CE2-CB 3.74Å; Y331-W333 HydrophobicContact CE2-CG 4.31Å; Y331-F345 HydrophobicContact CD1-CB 3.8Å; Y331-F345 HydrophobicContact CD2-CB 4.29Å; Y331-F345 HydrophobicContact CE1-CB 3.38Å; Y331-F345 HydrophobicContact CE1-CG 4.46Å; Y331-F345 HydrophobicContact CE2-CB 3.93Å; Y331-F345 HydrophobicContact CE2-CG 4.38Å; Y331-F345 HydrophobicContact CG-CB 4.25Å; Y331-F345 VanDerWaalsContact CZ-CB 3.47Å; Y331-F345 PolarHBondContact N-O 2.87Å; Y331-F345 PolarHBondContact O-N 3.46Å; Y331-F347 HydrophobicContact CD1-CD2 4.25Å; Y331-F347 AromaticContact CD1-CE2 3.95Å; Y331-F347 HydrophobicContact CD1-CE2 3.95Å; Y331-F347 HydrophobicContact CE1-CD2 4.33Å; Y331-F347 AromaticContact CE1-CE2 3.96Å; Y331-F347 HydrophobicContact CE1-CE2 3.96Å; Y331-F347 HydrophobicContact CE1-CZ 4.44Å
332	L	92.8	Very high	82	Confident	13 Å²	13	73.3 Å²	73.3	7%	0.068	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.1	-179.7	-62.6	-179	0	0	0	109.3	Y281 A284 N285 L288 P342 G343 I344	Y281-L332 HydrophobicContact CD2-CD1 4.24Å; Y281-L332 HydrophobicContact CD2-CD2 4.03Å; Y281-L332 HydrophobicContact CE2-CD1 3.88Å; Y281-L332 HydrophobicContact CE2-CD2 3.51Å; Y281-L332 HydrophobicContact CE2-CG 4.34Å; A284-L332 HydrophobicContact CB-CD1 4.04Å; A284-L332 HydrophobicContact CB-CG 4.3Å; N285-L332 VanDerWaalsContact CA-CD1 3.5Å; N285-L332 HydrophobicContact CB-CD1 3.69Å; L288-L332 HydrophobicContact CB-CB 4.49Å; L288-L332 HydrophobicContact CD2-CB 3.77Å; L332-P342 HydrophobicContact CB-CB 3.96Å; L332-P342 HydrophobicContact CB-CG 4.32Å; L332-P342 HydrophobicContact CD1-CG 4.33Å; L332-G343 WeakPolarHBondContact CA-O 3.45Å; L332-I344 HydrophobicContact CD2-CB 4.5Å; L332-I344 HydrophobicContact CD2-CG1 3.79Å
333	W	94.2	Very high	83.3	Confident	13 Å²	13	66 Å²	66	5%	0.049	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.6	-177.5	-177.7	-106.5	0	0	0	112.2	Y304 M305 M308 Y331 N335 G343 F345	Y304-W333 AromaticContact CD1-CH2 3.68Å; Y304-W333 HydrophobicContact CD1-CH2 3.68Å; Y304-W333 AromaticContact CD1-CZ3 3.78Å; Y304-W333 HydrophobicContact CD1-CZ3 3.78Å; Y304-W333 HydrophobicContact CE1-CE3 4.23Å; Y304-W333 AromaticContact CE1-CH2 3.5Å; Y304-W333 HydrophobicContact CE1-CH2 3.5Å; Y304-W333 AromaticContact CE1-CZ3 3.1Å; Y304-W333 HydrophobicContact CE1-CZ3 3.1Å; Y304-W333 HydrophobicContact CE2-CZ3 4.2Å; Y304-W333 HydrophobicContact CG-CH2 4.49Å; Y304-W333 AromaticContact CZ-CZ3 3.35Å; Y304-W333 WeakPolarHBondContact OH-CZ3 3.43Å; M305-W333 HydrophobicContact CG-CH2 4.31Å; M305-W333 HydrophobicContact CG-CZ2 4.39Å; M308-W333 HydrophobicContact CB-CD2 4.31Å; M308-W333 HydrophobicContact CB-CE3 4.35Å; M308-W333 HydrophobicContact CB-CH2 3.63Å; M308-W333 HydrophobicContact CB-CZ2 3.58Å; M308-W333 HydrophobicContact CB-CZ3 3.97Å; M308-W333 HydrophobicContact CE-CE3 4.29Å; M308-W333 HydrophobicContact CE-CZ3 4.08Å; M308-W333 HydrophobicContact CG-CD2 4.38Å; M308-W333 HydrophobicContact CG-CE3 3.93Å; M308-W333 HydrophobicContact CG-CH2 3.49Å; M308-W333 VanDerWaalsContact CG-CH2 3.49Å; M308-W333 HydrophobicContact CG-CZ2 3.98Å; M308-W333 HydrophobicContact CG-CZ3 3.41Å; M308-W333 VanDerWaalsContact CG-CZ3 3.41Å; M308-W333 HydrophobicContact SD-CE3 4.23Å; M308-W333 HydrophobicContact SD-CZ3 4.19Å; Y331-W333 HydrophobicContact CD2-CB 4.12Å; Y331-W333 HydrophobicContact CE2-CB 3.74Å; Y331-W333 HydrophobicContact CE2-CG 4.31Å; W333-N335 HydrophobicContact CZ2-CB 4.28Å; W333-G343 PolarHBondContact N-O 3.25Å; W333-G343 PolarHBondContact O-N 2.91Å; W333-F345 HydrophobicContact CB-CD2 3.58Å; W333-F345 HydrophobicContact CB-CE2 3.69Å; W333-F345 HydrophobicContact CB-CG 4.47Å; W333-F345 HydrophobicContact CG-CD2 4.48Å; W333-F345 HydrophobicContact CG-CE2 4.29Å
334	R	92.7	Very high	84.6	Confident	18 Å²	18	63 Å²	63	7%	0.068	34%	0.338	C	S	.	.			trans	-150.5	24.6	176.6	55	-169.4	-177.7	162.4	1.4	113.4	F289 E292 M336 N337 T338 I340 P342	F289-R334 VanDerWaalsContact CE1-NH2 3.3Å; E292-R334 VanDerWaalsContact OE1-CG 3.32Å; E292-R334 WeakPolarHBondContact OE1-CG 3.33Å; E292-R334 IonicContact OE1-CZ 2.63Å; E292-R334 IonicContact OE1-NE 3.46Å; E292-R334 PolarHBondContact OE1-NE 3.45Å; E292-R334 IonicContact OE1-NH2 2.83Å; E292-R334 IonicContact OE2-CZ 2.91Å; E292-R334 IonicContact OE2-NE 2.93Å; E292-R334 PolarHBondContact OE2-NE 2.71Å; E292-R334 IonicContact OE2-NH2 3.74Å; E292-R334 PolarHBondContact OE2-NH2 2.92Å; R334-M336 VanDerWaalsContact C-N 3.27Å; R334-M336 PolarHBondContact O-N 2.69Å; R334-N337 WeakPolarHBondContact CD-O 3.47Å; R334-N337 WeakPolarHBondContact CG-O 3.24Å; R334-N337 WeakPolarHBondContact O-CB 3.46Å; R334-N337 PolarHBondContact O-N 3.42Å; R334-T338 VanDerWaalsContact CZ-CA 3.47Å; R334-T338 PolarHBondContact NH1-O 2.92Å; R334-I340 HydrophobicContact CB-CD1 4.12Å; R334-I340 HydrophobicContact CB-CG1 3.98Å; R334-I340 VanDerWaalsContact CD-O 3.25Å; R334-I340 WeakPolarHBondContact CD-O 3.47Å; R334-I340 PolarHBondContact NH1-O 2.92Å; R334-P342 HydrophobicContact CB-CB 4.44Å; R334-P342 HydrophobicContact CG-CB 4.45Å
335	N	91.7	Very high	86.2	Confident	76 Å²	76	56 Å²	56	41%	0.406	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	46	179.3	-161.2	21	0	0	0	114.1	M305 W333 N337	M305-N335 WeakPolarHBondContact CG-OD1 3.21Å; M305-N335 PolarHBondContact SD-OD1 2.7Å; W333-N335 HydrophobicContact CZ2-CB 4.28Å; N335-N337 PolarHBondContact O-N 2.63Å
336	M	90.1	Very high	87.8	Confident	37 Å²	37	54 Å²	54	18%	0.182	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	3.9	-176.8	-61.4	-67.2	-68.9	0	0	115.9	E292 L295 T301 Y304 M305 R334 T338	E292-M336 HydrophobicContact CB-CE 4.32Å; E292-M336 HydrophobicContact CB-SD 4.3Å; E292-M336 HydrophobicContact CG-SD 3.88Å; L295-M336 HydrophobicContact CB-CE 3.97Å; T301-M336 HydrophobicContact CG2-CE 3.89Å; T301-M336 HydrophobicContact CG2-CG 3.92Å; T301-M336 HydrophobicContact CG2-SD 4.42Å; Y304-M336 HydrophobicContact CD1-SD 4.38Å; Y304-M336 HydrophobicContact CE1-SD 4.3Å; M305-M336 HydrophobicContact CG-CG 4.01Å; M305-M336 HydrophobicContact SD-CB 4.17Å; M305-M336 HydrophobicContact SD-CG 3.84Å; R334-M336 VanDerWaalsContact C-N 3.27Å; R334-M336 PolarHBondContact O-N 2.69Å; M336-T338 PolarHBondContact O-N 2.75Å
337	N	91.4	Very high	89.1	Confident	68 Å²	68	52.2 Å²	52.2	36%	0.364	28%	0.281	S	S	.	.			trans	-80.6	98.6	176	-176.2	-13.2	0	0	0	109.7	R334 N335 D339 I340	R334-N337 WeakPolarHBondContact CD-O 3.47Å; R334-N337 WeakPolarHBondContact CG-O 3.24Å; R334-N337 WeakPolarHBondContact O-CB 3.46Å; R334-N337 PolarHBondContact O-N 3.42Å; N335-N337 PolarHBondContact O-N 2.63Å; N337-D339 PolarHBondContact O-N 2.91Å; N337-D339 WeakPolarHBondContact OD1-CB 3.29Å; N337-D339 PolarHBondContact OD1-N 3.49Å; N337-D339 VanDerWaalsContact OD1-N 3.07Å; N337-I340 HydrophobicContact CB-CD1 4.19Å; N337-I340 HydrophobicContact CB-CG1 4.07Å; N337-I340 WeakPolarHBondContact O-CG1 3.38Å
338	T	89.4	Confident	89.8	Confident	82 Å²	82	52 Å²	52	50%	0.503	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.7	-175.9	51.9	0	0	0	0	114.5	R334 M336 I340	R334-T338 VanDerWaalsContact CZ-CA 3.47Å; R334-T338 PolarHBondContact NH1-O 2.92Å; M336-T338 PolarHBondContact O-N 2.75Å; T338-I340 VanDerWaalsContact C-N 3.33Å
339	D	91.5	Very high	90	Very high	146 Å²	146	56.6 Å²	56.6	78%	0.781	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-14.6	-175.5	-56.4	-32	0	0	0	112.5	N337	N337-D339 PolarHBondContact O-N 2.91Å; N337-D339 WeakPolarHBondContact OD1-CB 3.29Å; N337-D339 PolarHBondContact OD1-N 3.49Å; N337-D339 VanDerWaalsContact OD1-N 3.07Å
340	I	92.7	Very high	89.9	Confident	81 Å²	81	58 Å²	58	42%	0.415	30%	0.296	S	S	.	.	S	Bend	trans	-109	151.2	178.1	62.9	173	0	0	0	111.8	R334 N337 T338	R334-I340 HydrophobicContact CB-CD1 4.12Å; R334-I340 HydrophobicContact CB-CG1 3.98Å; R334-I340 VanDerWaalsContact CD-O 3.25Å; R334-I340 WeakPolarHBondContact CD-O 3.47Å; R334-I340 PolarHBondContact NH1-O 2.92Å; N337-I340 HydrophobicContact CB-CD1 4.19Å; N337-I340 HydrophobicContact CB-CG1 4.07Å; N337-I340 WeakPolarHBondContact O-CG1 3.38Å; T338-I340 VanDerWaalsContact C-N 3.33Å
341	P	92	Very high	89.6	Confident	110 Å²	110	56.1 Å²	56.1	71%	0.714	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-59.6	144	167.4	-21.3	33.1	0	0	0	111.2
342	P	93.6	Very high	88.9	Confident	19 Å²	19	63.3 Å²	63.3	12%	0.123	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-70.5	134.4	175.1	29	-32.7	0	0	0	112.3	L288 L332 R334	L288-P342 HydrophobicContact CD2-CB 3.69Å; L288-P342 HydrophobicContact CD2-CG 4.14Å; L332-P342 HydrophobicContact CB-CB 3.96Å; L332-P342 HydrophobicContact CB-CG 4.32Å; L332-P342 HydrophobicContact CD1-CG 4.33Å; R334-P342 HydrophobicContact CB-CB 4.44Å; R334-P342 HydrophobicContact CG-CB 4.45Å
343	G	92.2	Very high	88.1	Confident	20 Å²	20	66.7 Å²	66.7	21%	0.206	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	156.8	164.5	0	0	0	0	0	110.8	L332 W333	L332-G343 WeakPolarHBondContact CA-O 3.45Å; W333-G343 PolarHBondContact N-O 3.25Å; W333-G343 PolarHBondContact O-N 2.91Å
344	I	91.5	Very high	87.3	Confident	57 Å²	57	69.5 Å²	69.5	29%	0.292	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.5	179.5	-55.8	178.5	0	0	0	107.7	Y281 V320 R330 L332	Y281-I344 HydrophobicContact CE2-CD1 4.2Å; Y281-I344 HydrophobicContact CE2-CG1 4.44Å; V320-I344 HydrophobicContact CB-CB 4.4Å; V320-I344 HydrophobicContact CB-CG2 4.14Å; V320-I344 HydrophobicContact CG2-CG2 4.15Å; V320-I344 PolarHBondContact N-O 3.04Å; R330-I344 HydrophobicContact CB-CG2 4.35Å; R330-I344 HydrophobicContact CG-CG2 4.44Å; L332-I344 HydrophobicContact CD2-CB 4.5Å; L332-I344 HydrophobicContact CD2-CG1 3.79Å
345	F	91.4	Very high	86.4	Confident	21 Å²	21	80.7 Å²	80.7	9%	0.092	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	155.6	-178.1	-68.5	-95.9	0	0	0	110	I312 V317 E318 E319 R330 Y331 W333	I312-F345 HydrophobicContact CD1-CD1 4.38Å; I312-F345 HydrophobicContact CD1-CE1 3.91Å; I312-F345 HydrophobicContact CG1-CE1 4.46Å; V317-F345 HydrophobicContact CG1-CB 3.7Å; V317-F345 HydrophobicContact CG1-CD1 3.8Å; V317-F345 HydrophobicContact CG1-CG 4.2Å; E318-F345 CarbonylContact O-C 3.57Å; E318-F345 VanDerWaalsContact O-CA 3.32Å; E318-F345 WeakPolarHBondContact O-CA 3.28Å; E319-F345 HydrophobicContact CB-CD1 4.09Å; E319-F345 HydrophobicContact CB-CE1 3.83Å; E319-F345 HydrophobicContact CB-CZ 4.35Å; E319-F345 HydrophobicContact CG-CE1 4.24Å; E319-F345 HydrophobicContact CG-CZ 4.28Å; R330-F345 CarbonylContact C-O 3.59Å; R330-F345 WeakPolarHBondContact CA-O 3.31Å; Y331-F345 HydrophobicContact CD1-CB 3.8Å; Y331-F345 HydrophobicContact CD2-CB 4.29Å; Y331-F345 HydrophobicContact CE1-CB 3.38Å; Y331-F345 HydrophobicContact CE1-CG 4.46Å; Y331-F345 HydrophobicContact CE2-CB 3.93Å; Y331-F345 HydrophobicContact CE2-CG 4.38Å; Y331-F345 HydrophobicContact CG-CB 4.25Å; Y331-F345 VanDerWaalsContact CZ-CB 3.47Å; Y331-F345 PolarHBondContact N-O 2.87Å; Y331-F345 PolarHBondContact O-N 3.46Å; W333-F345 HydrophobicContact CB-CD2 3.58Å; W333-F345 HydrophobicContact CB-CE2 3.69Å; W333-F345 HydrophobicContact CB-CG 4.47Å; W333-F345 HydrophobicContact CG-CD2 4.48Å; W333-F345 HydrophobicContact CG-CE2 4.29Å
346	R	87.8	Confident	85.8	Confident	22 Å²	22	79.9 Å²	79.9	8%	0.083	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.8	175	70.4	178.2	179.9	-172.9	-5.3	111.9	V317 E318 V320 D325 R326 R330	V317-R346 VanDerWaalsContact CA-O 3.25Å; V317-R346 WeakPolarHBondContact CA-O 3.21Å; V317-R346 WeakPolarHBondContact CG1-O 3.35Å; E318-R346 HydrophobicContact CG-CG 3.94Å; E318-R346 PolarHBondContact N-O 3.46Å; E318-R346 VanDerWaalsContact N-O 3.12Å; E318-R346 PolarHBondContact O-N 3.36Å; E318-R346 IonicContact OE1-CZ 3.35Å; E318-R346 IonicContact OE1-NE 2.99Å; E318-R346 PolarHBondContact OE1-NE 2.93Å; E318-R346 IonicContact OE1-NH2 2.8Å; E318-R346 PolarHBondContact OE1-NH2 3.42Å; V320-R346 HydrophobicContact CG2-CB 3.93Å; V320-R346 HydrophobicContact CG2-CG 3.79Å; D325-R346 IonicContact OD1-CZ 2.89Å; D325-R346 IonicContact OD1-NH1 3.73Å; D325-R346 PolarHBondContact OD1-NH1 2.84Å; D325-R346 IonicContact OD1-NH2 2.7Å; D325-R346 PolarHBondContact OD1-NH2 3.02Å; D325-R346 IonicContact OD2-CZ 2.59Å; D325-R346 IonicContact OD2-NH1 3.53Å; D325-R346 IonicContact OD2-NH2 3.99Å; D325-R346 PolarHBondContact OD2-NH2 3.35Å; R326-R346 PolarHBondContact O-NH1 3.01Å; R326-R346 VanDerWaalsContact O-NH1 3.13Å; R330-R346 HydrophobicContact CG-CB 4.08Å
347	F	88	Confident	85.4	Confident	52 Å²	52	78.5 Å²	78.5	23%	0.228	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	136.3	168.6	-73.6	-87.5	0	0	0	110.8	Y311 W316 V317 T329 Y331 T351	Y311-F347 HydrophobicContact CD2-CE1 4.14Å; Y311-F347 HydrophobicContact CD2-CZ 4.16Å; Y311-F347 HydrophobicContact CE2-CE1 4.4Å; Y311-F347 HydrophobicContact CE2-CZ 4.27Å; Y311-F347 HydrophobicContact CG-CE1 4.37Å; W316-F347 WeakPolarHBondContact O-CA 3.27Å; V317-F347 HydrophobicContact CG2-CD1 3.52Å; V317-F347 HydrophobicContact CG2-CD2 4.37Å; V317-F347 HydrophobicContact CG2-CE1 3.56Å; V317-F347 HydrophobicContact CG2-CE2 4.39Å; V317-F347 HydrophobicContact CG2-CG 3.96Å; V317-F347 HydrophobicContact CG2-CZ 4.02Å; T329-F347 PolarHBondContact O-N 2.78Å; Y331-F347 HydrophobicContact CD1-CD2 4.25Å; Y331-F347 AromaticContact CD1-CE2 3.95Å; Y331-F347 HydrophobicContact CD1-CE2 3.95Å; Y331-F347 HydrophobicContact CE1-CD2 4.33Å; Y331-F347 AromaticContact CE1-CE2 3.96Å; Y331-F347 HydrophobicContact CE1-CE2 3.96Å; Y331-F347 HydrophobicContact CE1-CZ 4.44Å; F347-T351 HydrophobicContact CB-CG2 3.56Å; F347-T351 HydrophobicContact CD1-CG2 3.46Å; F347-T351 VanDerWaalsContact CD1-CG2 3.46Å; F347-T351 HydrophobicContact CD2-CG2 3.51Å; F347-T351 HydrophobicContact CE1-CG2 3.96Å; F347-T351 HydrophobicContact CE2-CG2 4.01Å; F347-T351 HydrophobicContact CG-CG2 3.2Å; F347-T351 HydrophobicContact CZ-CG2 4.21Å
348	I	83.6	Confident	84.6	Confident	56 Å²	56	78.1 Å²	78.1	29%	0.287	41%	0.414	S	S	.	.	S	Bend	trans	-100.2	2.7	175	72.5	166.4	0	0	0	112.8	G315 W316 E318	G315-I348 WeakPolarHBondContact O-CD1 3.37Å; G315-I348 WeakPolarHBondContact O-CG1 3.49Å; W316-I348 WeakPolarHBondContact O-CG1 3.43Å; W316-I348 PolarHBondContact O-N 3.48Å; E318-I348 HydrophobicContact CG-CG2 3.84Å
349	R	82.6	Confident	84.2	Confident	149 Å²	149	77.4 Å²	77.4	56%	0.562	40%	0.404	S	S	*	.	S	Bend	trans	-127.9	156	178.2	-60	-173	178.5	-165.5	-2.5	109.7	W316 T351	W316-R349 VanDerWaalsContact CD1-CZ 3.47Å; W316-R349 VanDerWaalsContact NE1-NH1 3.13Å; R349-T351 PolarHBondContact O-N 3.41Å
350	L	82.9	Confident	83.8	Confident	84 Å²	84	72.3 Å²	72.3	44%	0.44	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-61.5	120.1	173.9	-173.7	63.9	0	0	0	109.8	S357 L360 A361	L350-S357 WeakPolarHBondContact CD2-O 3.17Å; L350-L360 HydrophobicContact CD1-CB 4.16Å; L350-L360 HydrophobicContact CD1-CD1 3.88Å; L350-L360 HydrophobicContact CD2-CB 4.1Å; L350-A361 HydrophobicContact CD2-CB 3.77Å
351	T	79.7	Confident	83.3	Confident	21 Å²	21	69.7 Å²	69.7	13%	0.129	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-83.8	140.9	-175.2	49.7	0	0	0	0	111.8	F347 R349 L354 S357	F347-T351 HydrophobicContact CB-CG2 3.56Å; F347-T351 HydrophobicContact CD1-CG2 3.46Å; F347-T351 VanDerWaalsContact CD1-CG2 3.46Å; F347-T351 HydrophobicContact CD2-CG2 3.51Å; F347-T351 HydrophobicContact CE1-CG2 3.96Å; F347-T351 HydrophobicContact CE2-CG2 4.01Å; F347-T351 HydrophobicContact CG-CG2 3.2Å; F347-T351 HydrophobicContact CZ-CG2 4.21Å; R349-T351 PolarHBondContact O-N 3.41Å; T351-L354 WeakPolarHBondContact OG1-CD1 3.22Å; T351-L354 WeakPolarHBondContact OG1-CG 3.38Å; T351-S357 WeakPolarHBondContact O-CB 3.38Å; T351-S357 PolarHBondContact O-OG 3.27Å
352	F	76	Confident	82.8	Confident	185 Å²	185	65.4 Å²	65.4	81%	0.811	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	147.6	169.4	-72	-87.2	0	0	0	110.7
353	G	74.7	Confident	82.4	Confident	83 Å²	83	65.3 Å²	65.3	86%	0.856	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	-6.3	174.7	0	0	0	0	0	116
354	L	78.4	Confident	82.2	Confident	73 Å²	73	65.1 Å²	65.1	38%	0.382	33%	0.331	S	S	.	.			trans	-77.2	140	165.1	-47.9	177	0	0	0	109.6	T329 T351 S356 S357	T329-L354 HydrophobicContact CG2-CD1 3.91Å; T351-L354 WeakPolarHBondContact OG1-CD1 3.22Å; T351-L354 WeakPolarHBondContact OG1-CG 3.38Å; L354-S356 PolarHBondContact O-N 3.12Å; L354-S356 VanDerWaalsContact O-N 3.13Å; L354-S357 WeakPolarHBondContact CB-OG 3.41Å; L354-S357 WeakPolarHBondContact O-CB 3.37Å; L354-S357 PolarHBondContact O-N 2.92Å
355	R	73.9	Confident	82	Confident	253 Å²	253	62.8 Å²	62.8	96%	0.955	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.4	177.2	-72.8	-173.8	-77.4	178.9	-3.4	113
356	S	78.2	Confident	81.9	Confident	59 Å²	59	64.1 Å²	64.1	41%	0.413	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-18.3	179.6	52.8	0	0	0	0	113.8	L354 T358 F359 L360	L354-S356 PolarHBondContact O-N 3.12Å; L354-S356 VanDerWaalsContact O-N 3.13Å; S356-T358 PolarHBondContact O-N 3.27Å; S356-F359 WeakPolarHBondContact O-CB 3.44Å; S356-F359 PolarHBondContact O-N 2.85Å; S356-L360 VanDerWaalsContact O-CG 3.31Å; S356-L360 WeakPolarHBondContact O-CG 3.21Å; S356-L360 PolarHBondContact O-N 3.1Å
357	S	81.1	Confident	81.9	Confident	8 Å²	8	65 Å²	65	6%	0.056	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-42.7	-169.1	-69.1	0	0	0	0	112.8	L350 T351 L354 F359 L360 A361	L350-S357 WeakPolarHBondContact CD2-O 3.17Å; T351-S357 WeakPolarHBondContact O-CB 3.38Å; T351-S357 PolarHBondContact O-OG 3.27Å; L354-S357 WeakPolarHBondContact CB-OG 3.41Å; L354-S357 WeakPolarHBondContact O-CB 3.37Å; L354-S357 PolarHBondContact O-N 2.92Å; S357-F359 VanDerWaalsContact C-N 3.29Å; S357-F359 PolarHBondContact O-N 2.7Å; S357-L360 PolarHBondContact O-N 3.33Å; S357-A361 WeakPolarHBondContact O-CB 3.35Å; S357-A361 PolarHBondContact O-N 3.13Å
358	T	75	Confident	82.1	Confident	59 Å²	59	62.6 Å²	62.6	36%	0.362	32%	0.32	S	S	.	.	H	α-helix	trans	-56.2	-46.3	176.7	-58.7	0	0	0	0	111.7	I241 S356 I362 V389	I241-T358 HydrophobicContact CD1-CG2 4.38Å; S356-T358 PolarHBondContact O-N 3.27Å; T358-I362 WeakPolarHBondContact O-CG2 3.28Å; T358-I362 PolarHBondContact O-N 2.95Å; T358-V389 HydrophobicContact CG2-CB 4.18Å; T358-V389 HydrophobicContact CG2-CG1 3.73Å; T358-V389 HydrophobicContact CG2-CG2 3.36Å
359	F	80.3	Confident	82.5	Confident	67 Å²	67	59.9 Å²	59.9	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-48.6	177.4	173.7	-93.4	0	0	0	111.5	I256 S356 S357 A361 I362 M363	I256-F359 HydrophobicContact CD1-CE2 4.24Å; I256-F359 HydrophobicContact CD1-CZ 4.11Å; I256-F359 HydrophobicContact CG1-CE2 4.34Å; I256-F359 HydrophobicContact CG1-CZ 3.72Å; S356-F359 WeakPolarHBondContact O-CB 3.44Å; S356-F359 PolarHBondContact O-N 2.85Å; S357-F359 VanDerWaalsContact C-N 3.29Å; S357-F359 PolarHBondContact O-N 2.7Å; F359-A361 PolarHBondContact O-N 2.58Å; F359-I362 VanDerWaalsContact O-CG2 3.31Å; F359-I362 WeakPolarHBondContact O-CG2 3.42Å; F359-I362 PolarHBondContact O-N 3.31Å; F359-M363 HydrophobicContact CD1-CG 4.2Å; F359-M363 HydrophobicContact CD2-CG 4.14Å; F359-M363 HydrophobicContact CE1-CG 3.64Å; F359-M363 HydrophobicContact CE2-CG 3.57Å; F359-M363 HydrophobicContact CE2-SD 3.88Å; F359-M363 HydrophobicContact CG-CG 4.4Å; F359-M363 HydrophobicContact CZ-CG 3.24Å; F359-M363 HydrophobicContact CZ-SD 3.87Å; F359-M363 WeakPolarHBondContact O-CB 3.37Å; F359-M363 WeakPolarHBondContact O-CG 3.47Å; F359-M363 PolarHBondContact O-N 2.79Å
360	L	83.1	Confident	82.9	Confident	40 Å²	40	58.8 Å²	58.8	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-46.9	179.8	-64.9	170.8	0	0	0	111	Y259 L350 S356 S357 I362 M363 V364	Y259-L360 HydrophobicContact CD2-CD2 4.04Å; Y259-L360 HydrophobicContact CE1-CD2 4.09Å; Y259-L360 HydrophobicContact CE2-CD2 3.41Å; Y259-L360 VanDerWaalsContact CE2-CD2 3.41Å; Y259-L360 VanDerWaalsContact CZ-CD2 3.46Å; L350-L360 HydrophobicContact CD1-CB 4.16Å; L350-L360 HydrophobicContact CD1-CD1 3.88Å; L350-L360 HydrophobicContact CD2-CB 4.1Å; S356-L360 VanDerWaalsContact O-CG 3.31Å; S356-L360 WeakPolarHBondContact O-CG 3.21Å; S356-L360 PolarHBondContact O-N 3.1Å; S357-L360 PolarHBondContact O-N 3.33Å; L360-I362 PolarHBondContact O-N 3.48Å; L360-M363 PolarHBondContact O-N 3Å; L360-V364 VanDerWaalsContact O-CG2 3.29Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.43Å
361	A	83.5	Confident	83.3	Confident	26 Å²	26	59.9 Å²	59.9	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-55.9	-53	179.4	0	0	0	0	0	111.9	L350 S357 F359 M363 V364 V365	L350-A361 HydrophobicContact CD2-CB 3.77Å; S357-A361 WeakPolarHBondContact O-CB 3.35Å; S357-A361 PolarHBondContact O-N 3.13Å; F359-A361 PolarHBondContact O-N 2.58Å; A361-M363 VanDerWaalsContact C-N 3.33Å; A361-M363 PolarHBondContact O-N 3.19Å; A361-V364 PolarHBondContact O-N 3.05Å; A361-V365 WeakPolarHBondContact O-CG2 3.34Å; A361-V365 PolarHBondContact O-N 3.27Å; A361-V365 VanDerWaalsContact O-N 3.12Å
362	I	81.7	Confident	84	Confident	20 Å²	20	60.7 Å²	60.7	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-35.7	-178.1	-166.9	59.2	0	0	0	111.8	T358 F359 L360 V365 Q366	T358-I362 WeakPolarHBondContact O-CG2 3.28Å; T358-I362 PolarHBondContact O-N 2.95Å; F359-I362 VanDerWaalsContact O-CG2 3.31Å; F359-I362 WeakPolarHBondContact O-CG2 3.42Å; F359-I362 PolarHBondContact O-N 3.31Å; L360-I362 PolarHBondContact O-N 3.48Å; I362-V365 PolarHBondContact O-N 3.27Å; I362-Q366 HydrophobicContact CD1-CG 4.49Å; I362-Q366 HydrophobicContact CG1-CG 4.36Å; I362-Q366 WeakPolarHBondContact O-CB 3.45Å; I362-Q366 VanDerWaalsContact O-CG 3.29Å; I362-Q366 WeakPolarHBondContact O-CG 3.34Å; I362-Q366 PolarHBondContact O-N 3.05Å
363	M	83.9	Confident	84.9	Confident	17 Å²	17	54.6 Å²	54.6	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-42.5	177.6	-73.9	-52.4	-54.5	0	0	112.8	I256 Y259 I260 F359 L360 A361 V365 Q366 H367	I256-M363 HydrophobicContact CG2-CE 3.79Å; Y259-M363 HydrophobicContact CD1-CB 4.37Å; Y259-M363 HydrophobicContact CE1-CB 4.05Å; I260-M363 HydrophobicContact CD1-CE 3.39Å; I260-M363 HydrophobicContact CG1-CE 3.77Å; F359-M363 HydrophobicContact CD1-CG 4.2Å; F359-M363 HydrophobicContact CD2-CG 4.14Å; F359-M363 HydrophobicContact CE1-CG 3.64Å; F359-M363 HydrophobicContact CE2-CG 3.57Å; F359-M363 HydrophobicContact CE2-SD 3.88Å; F359-M363 HydrophobicContact CG-CG 4.4Å; F359-M363 HydrophobicContact CZ-CG 3.24Å; F359-M363 HydrophobicContact CZ-SD 3.87Å; F359-M363 WeakPolarHBondContact O-CB 3.37Å; F359-M363 WeakPolarHBondContact O-CG 3.47Å; F359-M363 PolarHBondContact O-N 2.79Å; L360-M363 PolarHBondContact O-N 3Å; A361-M363 VanDerWaalsContact C-N 3.33Å; A361-M363 PolarHBondContact O-N 3.19Å; M363-V365 VanDerWaalsContact C-N 3.34Å; M363-Q366 PolarHBondContact O-N 2.88Å; M363-H367 VanDerWaalsContact O-CB 3.31Å; M363-H367 WeakPolarHBondContact O-CB 3.27Å; M363-H367 PolarHBondContact O-N 2.94Å
364	V	88.5	Confident	85.8	Confident	16 Å²	16	59.2 Å²	59.2	10%	0.097	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-46.4	175.6	178.5	0	0	0	0	110.4	Y259 I263 Y270 L360 A361 Q366 H367 H368 F418	Y259-V364 HydrophobicContact CE1-CG2 4.28Å; Y259-V364 VanDerWaalsContact OH-CG2 3.25Å; Y259-V364 WeakPolarHBondContact OH-CG2 3.48Å; I263-V364 HydrophobicContact CD1-CB 4.25Å; I263-V364 HydrophobicContact CD1-CG1 4.13Å; I263-V364 HydrophobicContact CD1-CG2 3.37Å; Y270-V364 HydrophobicContact CD1-CG1 4.15Å; Y270-V364 HydrophobicContact CD2-CG1 3.32Å; Y270-V364 HydrophobicContact CE2-CG1 4.06Å; Y270-V364 HydrophobicContact CG-CG1 3.37Å; L360-V364 VanDerWaalsContact O-CG2 3.29Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.43Å; A361-V364 PolarHBondContact O-N 3.05Å; V364-Q366 PolarHBondContact O-N 3.48Å; V364-H367 PolarHBondContact O-N 3.24Å; V364-H368 VanDerWaalsContact O-CB 3.31Å; V364-H368 WeakPolarHBondContact O-CB 3.26Å; V364-H368 PolarHBondContact O-N 3.09Å; V364-F418 HydrophobicContact CG1-CZ 3.8Å
365	V	88.6	Confident	86.6	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-43.3	179.2	169	0	0	0	0	111.5	A361 I362 M363 H368 A369 V383 M387 M413 F418	A361-V365 WeakPolarHBondContact O-CG2 3.34Å; A361-V365 PolarHBondContact O-N 3.27Å; A361-V365 VanDerWaalsContact O-N 3.12Å; I362-V365 PolarHBondContact O-N 3.27Å; M363-V365 VanDerWaalsContact C-N 3.34Å; V365-H368 PolarHBondContact O-N 2.89Å; V365-A369 WeakPolarHBondContact O-CB 3.48Å; V365-A369 PolarHBondContact O-N 2.92Å; V365-V383 HydrophobicContact CG1-CG1 3.48Å; V365-V383 VanDerWaalsContact CG1-CG1 3.48Å; V365-M387 HydrophobicContact CG1-CE 4.05Å; V365-M387 HydrophobicContact CG1-CG 4.41Å; V365-M387 HydrophobicContact CG1-SD 3.52Å; V365-M387 VanDerWaalsContact CG1-SD 3.52Å; V365-M387 HydrophobicContact CG2-CE 4.17Å; V365-M413 HydrophobicContact CG1-CE 4.18Å; V365-M413 HydrophobicContact CG2-CE 4.46Å; V365-F418 HydrophobicContact CG2-CE1 4.5Å; V365-F418 HydrophobicContact CG2-CZ 4.33Å
366	Q	87.3	Confident	87.6	Confident	49 Å²	49	50.9 Å²	50.9	23%	0.229	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-41.1	176.4	-73.5	-171.8	3.2	0	0	112.5	I362 M363 V364 H368 A369 R370 L384	I362-Q366 HydrophobicContact CD1-CG 4.49Å; I362-Q366 HydrophobicContact CG1-CG 4.36Å; I362-Q366 WeakPolarHBondContact O-CB 3.45Å; I362-Q366 VanDerWaalsContact O-CG 3.29Å; I362-Q366 WeakPolarHBondContact O-CG 3.34Å; I362-Q366 PolarHBondContact O-N 3.05Å; M363-Q366 PolarHBondContact O-N 2.88Å; V364-Q366 PolarHBondContact O-N 3.48Å; Q366-H368 VanDerWaalsContact C-N 3.34Å; Q366-A369 PolarHBondContact O-N 2.82Å; Q366-R370 WeakPolarHBondContact O-CG 3.41Å; Q366-R370 PolarHBondContact O-N 2.96Å; Q366-L384 HydrophobicContact CB-CD2 3.92Å; Q366-L384 HydrophobicContact CG-CD2 4Å
367	H	88.5	Confident	88.3	Confident	42 Å²	42	53.5 Å²	53.5	19%	0.194	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-47.3	174.7	172	78.8	0	0	0	110.6	I260 Y270 M363 V364 A369 R370 L371	I260-H367 WeakPolarHBondContact CG2-ND1 3.4Å; Y270-H367 AromaticContact CE1-CD2 3.76Å; M363-H367 VanDerWaalsContact O-CB 3.31Å; M363-H367 WeakPolarHBondContact O-CB 3.27Å; M363-H367 PolarHBondContact O-N 2.94Å; V364-H367 PolarHBondContact O-N 3.24Å; H367-A369 PolarHBondContact O-N 3.14Å; H367-R370 PolarHBondContact O-N 3.07Å; H367-L371 WeakPolarHBondContact O-CB 3.37Å; H367-L371 PolarHBondContact O-N 2.9Å
368	H	92.3	Very high	88.6	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-48	176.3	-179.8	64.9	0	0	0	112.3	Y270 V364 V365 Q366 R370 L371 H372 L412 G416 F418	Y270-H368 HydrophobicContact CE2-CB 3.86Å; Y270-H368 AromaticContact CE2-CG 3.94Å; Y270-H368 AromaticContact CE2-ND1 3.67Å; Y270-H368 AromaticContact CZ-ND1 3.64Å; Y270-H368 WeakPolarHBondContact OH-CB 3.31Å; Y270-H368 PolarHBondContact OH-ND1 3.47Å; V364-H368 VanDerWaalsContact O-CB 3.31Å; V364-H368 WeakPolarHBondContact O-CB 3.26Å; V364-H368 PolarHBondContact O-N 3.09Å; V365-H368 PolarHBondContact O-N 2.89Å; Q366-H368 VanDerWaalsContact C-N 3.34Å; H368-R370 PolarHBondContact O-N 3.02Å; H368-L371 PolarHBondContact O-N 3.01Å; H368-H372 AromaticContact CE1-CD2 3.26Å; H368-H372 PolarHBondContact CE1-CD2 2.82Å; H368-H372 AromaticContact CE1-NE2 3.43Å; H368-H372 PolarHBondContact CE1-NE2 2.83Å; H368-H372 AromaticContact ND1-CD2 3.47Å; H368-H372 PolarHBondContact ND1-CD2 2.8Å; H368-H372 AromaticContact ND1-NE2 3.64Å; H368-H372 AromaticContact NE2-CD2 3.95Å; H368-H372 PolarHBondContact O-CD2 3.01Å; H368-H372 VanDerWaalsContact O-CD2 3.26Å; H368-H372 PolarHBondContact O-N 2.92Å; H368-L412 PolarHBondContact NE2-O 3.09Å; H368-G416 WeakPolarHBondContact CE1-CA 3.33Å; H368-G416 PolarHBondContact CE1-N 2.81Å; H368-G416 PolarHBondContact NE2-N 2.78Å; H368-F418 HydrophobicContact CB-CE2 4.27Å
369	A	91.4	Very high	89.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-42.4	177.3	0	0	0	0	0	112.4	V365 Q366 H367 H372 I373 A380 V383 L384	V365-A369 WeakPolarHBondContact O-CB 3.48Å; V365-A369 PolarHBondContact O-N 2.92Å; Q366-A369 PolarHBondContact O-N 2.82Å; H367-A369 PolarHBondContact O-N 3.14Å; A369-H372 PolarHBondContact O-N 2.65Å; A369-I373 PolarHBondContact O-N 2.8Å; A369-I373 VanDerWaalsContact O-N 3.09Å; A369-A380 HydrophobicContact CB-CB 4.34Å; A369-A380 WeakPolarHBondContact O-CB 3.2Å; A369-V383 HydrophobicContact CB-CB 4.06Å; A369-V383 HydrophobicContact CB-CG1 3.77Å; A369-L384 HydrophobicContact CB-CD1 4.5Å; A369-L384 HydrophobicContact CB-CD2 4.01Å; A369-L384 HydrophobicContact CB-CG 3.89Å
370	R	91.4	Very high	89.8	Confident	126 Å²	126	50 Å²	50	48%	0.475	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-38.6	176.3	-72.8	177.4	-172	123.3	5.4	112.4	Q366 H367 H368 H372 I373 L384	Q366-R370 WeakPolarHBondContact O-CG 3.41Å; Q366-R370 PolarHBondContact O-N 2.96Å; H367-R370 PolarHBondContact O-N 3.07Å; H368-R370 PolarHBondContact O-N 3.02Å; R370-H372 PolarHBondContact O-N 2.97Å; R370-I373 VanDerWaalsContact O-CG2 3.26Å; R370-I373 WeakPolarHBondContact O-CG2 3.5Å; R370-I373 PolarHBondContact O-N 3.13Å; R370-L384 HydrophobicContact CG-CD1 4Å; R370-L384 HydrophobicContact CG-CD2 3.95Å
371	L	92.1	Very high	90	Very high	106 Å²	106	52.7 Å²	52.7	56%	0.555	26%	0.256	S	S	*	.	H	α-helix	trans	-61.9	-32.1	179	-174.4	65.9	0	0	0	112.3	H367 H368	H367-L371 WeakPolarHBondContact O-CB 3.37Å; H367-L371 PolarHBondContact O-N 2.9Å; H368-L371 PolarHBondContact O-N 3.01Å
372	H	94.4	Very high	90	Very high	39 Å²	39	52.9 Å²	52.9	18%	0.181	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	13.4	-175.7	-63.4	-66	0	0	0	113.9	H368 A369 R370 E374 T375 Y376 L412	H368-H372 AromaticContact CE1-CD2 3.26Å; H368-H372 PolarHBondContact CE1-CD2 2.82Å; H368-H372 AromaticContact CE1-NE2 3.43Å; H368-H372 PolarHBondContact CE1-NE2 2.83Å; H368-H372 AromaticContact ND1-CD2 3.47Å; H368-H372 PolarHBondContact ND1-CD2 2.8Å; H368-H372 AromaticContact ND1-NE2 3.64Å; H368-H372 AromaticContact NE2-CD2 3.95Å; H368-H372 PolarHBondContact O-CD2 3.01Å; H368-H372 VanDerWaalsContact O-CD2 3.26Å; H368-H372 PolarHBondContact O-N 2.92Å; A369-H372 PolarHBondContact O-N 2.65Å; R370-H372 PolarHBondContact O-N 2.97Å; H372-E374 VanDerWaalsContact C-N 3.27Å; H372-E374 PolarHBondContact O-N 2.89Å; H372-T375 PolarHBondContact O-N 2.95Å; H372-T375 VanDerWaalsContact O-N 3.17Å; H372-Y376 HydrophobicContact CB-CD2 4.2Å; H372-Y376 PolarHBondContact O-N 2.89Å; H372-L412 HydrophobicContact CB-CD1 3.45Å; H372-L412 VanDerWaalsContact CB-CD1 3.45Å
373	I	93.6	Very high	90.1	Very high	57 Å²	57	52 Å²	52	29%	0.292	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-32.1	-175.5	-163.5	165.8	0	0	0	112.7	A369 R370 T375 M377 A380 L384	A369-I373 PolarHBondContact O-N 2.8Å; A369-I373 VanDerWaalsContact O-N 3.09Å; R370-I373 VanDerWaalsContact O-CG2 3.26Å; R370-I373 WeakPolarHBondContact O-CG2 3.5Å; R370-I373 PolarHBondContact O-N 3.13Å; I373-T375 VanDerWaalsContact C-N 3.33Å; I373-T375 PolarHBondContact O-N 2.78Å; I373-M377 WeakPolarHBondContact O-CA 3.4Å; I373-M377 WeakPolarHBondContact O-CB 3.38Å; I373-M377 PolarHBondContact O-N 3.31Å; I373-A380 HydrophobicContact CB-CB 4.05Å; I373-A380 HydrophobicContact CG1-CB 3.89Å; I373-L384 HydrophobicContact CD1-CD1 4.15Å
374	E	94	Very high	90.1	Very high	180 Å²	180	53.4 Å²	53.4	84%	0.841	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-34.4	178.7	-62.6	-171.8	164.4	0	0	111.9	H372	H372-E374 VanDerWaalsContact C-N 3.27Å; H372-E374 PolarHBondContact O-N 2.89Å
375	T	96	Very high	89.5	Confident	103 Å²	103	56.5 Å²	56.5	63%	0.632	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-39.4	-178.6	-49.9	0	0	0	0	112.5	H372 I373	H372-T375 PolarHBondContact O-N 2.95Å; H372-T375 VanDerWaalsContact O-N 3.17Å; I373-T375 VanDerWaalsContact C-N 3.33Å; I373-T375 PolarHBondContact O-N 2.78Å
376	Y	95	Very high	88.7	Confident	47 Å²	47	56.8 Å²	56.8	18%	0.184	28%	0.279	C	S	.	.	S	Bend	trans	-122.9	46.2	-175.2	-59.6	-79.9	0	0	0	111.7	H372 R378 A379 A380 Q408 K411 L412 L415	H372-Y376 HydrophobicContact CB-CD2 4.2Å; H372-Y376 PolarHBondContact O-N 2.89Å; Y376-R378 PolarHBondContact O-N 3.19Å; Y376-R378 VanDerWaalsContact O-N 3.17Å; Y376-A379 PolarHBondContact O-N 2.83Å; Y376-A379 VanDerWaalsContact O-N 3.08Å; Y376-A380 WeakPolarHBondContact O-CB 3.27Å; Y376-A380 PolarHBondContact O-N 2.92Å; Y376-Q408 HydrophobicContact CD1-CB 4.41Å; Y376-K411 HydrophobicContact CE1-CB 3.74Å; Y376-K411 HydrophobicContact CE1-CD 4.43Å; Y376-L412 HydrophobicContact CD2-CB 4.25Å; Y376-L412 HydrophobicContact CD2-CD1 4.07Å; Y376-L412 HydrophobicContact CG-CB 4.11Å; Y376-L412 HydrophobicContact CG-CD1 4.47Å; Y376-L415 HydrophobicContact CD2-CD1 4.44Å; Y376-L415 HydrophobicContact CE2-CD1 3.57Å
377	M	92.2	Very high	88.2	Confident	115 Å²	115	56 Å²	56	57%	0.567	28%	0.275	S	S	*	.	H	α-helix	trans	-42.5	-55.8	-171.4	-174.9	177.8	-71.9	0	0	113.9	I373 A380 E381	I373-M377 WeakPolarHBondContact O-CA 3.4Å; I373-M377 WeakPolarHBondContact O-CB 3.38Å; I373-M377 PolarHBondContact O-N 3.31Å; M377-A380 PolarHBondContact O-N 2.87Å; M377-E381 WeakPolarHBondContact O-CB 3.17Å; M377-E381 VanDerWaalsContact O-CG 3.29Å; M377-E381 WeakPolarHBondContact O-CG 3.49Å; M377-E381 PolarHBondContact O-N 2.85Å
378	R	88.2	Confident	87.2	Confident	59 Å²	59	56.6 Å²	56.6	22%	0.223	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-47.1	-177.7	-171.5	174.4	170	-128.1	-13.2	112.4	Y376 E382 E401 L405	Y376-R378 PolarHBondContact O-N 3.19Å; Y376-R378 VanDerWaalsContact O-N 3.17Å; R378-E382 WeakPolarHBondContact O-CB 3.45Å; R378-E382 WeakPolarHBondContact O-CG 3.33Å; R378-E382 PolarHBondContact O-N 3.29Å; R378-E382 VanDerWaalsContact O-N 3.07Å; R378-E401 IonicContact CZ-OE1 2.8Å; R378-E401 IonicContact NE-OE1 3.66Å; R378-E401 PolarHBondContact NE-OE1 2.62Å; R378-E401 PolarHBondContact NH1-O 2.87Å; R378-E401 IonicContact NH1-OE1 3.42Å; R378-E401 PolarHBondContact NH2-O 2.77Å; R378-E401 IonicContact NH2-OE1 2.92Å; R378-E401 PolarHBondContact NH2-OE1 3.14Å; R378-E401 IonicContact NH2-OE2 2.75Å; R378-L405 HydrophobicContact CG-CD1 4.28Å
379	A	90	Very high	86.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-37.4	178.5	0	0	0	0	0	113	Y376 E382 V383 L405 Q408 L409 L412	Y376-A379 PolarHBondContact O-N 2.83Å; Y376-A379 VanDerWaalsContact O-N 3.08Å; A379-E382 PolarHBondContact O-N 3.11Å; A379-V383 WeakPolarHBondContact O-CG2 2.95Å; A379-V383 PolarHBondContact O-N 3.37Å; A379-L405 HydrophobicContact CB-CD1 4.19Å; A379-Q408 HydrophobicContact CB-CB 3.7Å; A379-L409 HydrophobicContact CB-CD2 3.94Å; A379-L409 HydrophobicContact CB-CG 4.02Å; A379-L412 HydrophobicContact CB-CD2 3.95Å
380	A	90.6	Very high	85.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.5	-43.5	177.2	0	0	0	0	0	111.7	A369 I373 Y376 M377 E382 V383 L384 L412	A369-A380 HydrophobicContact CB-CB 4.34Å; A369-A380 WeakPolarHBondContact O-CB 3.2Å; I373-A380 HydrophobicContact CB-CB 4.05Å; I373-A380 HydrophobicContact CG1-CB 3.89Å; Y376-A380 WeakPolarHBondContact O-CB 3.27Å; Y376-A380 PolarHBondContact O-N 2.92Å; M377-A380 PolarHBondContact O-N 2.87Å; A380-E382 VanDerWaalsContact C-N 3.28Å; A380-E382 PolarHBondContact O-N 3.46Å; A380-V383 PolarHBondContact O-N 2.95Å; A380-L384 WeakPolarHBondContact O-CB 3.46Å; A380-L384 WeakPolarHBondContact O-CG 3.37Å; A380-L384 PolarHBondContact O-N 2.84Å; A380-L412 HydrophobicContact CB-CD2 4.16Å
381	E	87.5	Confident	84.2	Confident	97 Å²	97	59.7 Å²	59.7	45%	0.453	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-42.6	172.9	-76	-179.8	169.2	0	0	111.5	M377 L384 S385	M377-E381 WeakPolarHBondContact O-CB 3.17Å; M377-E381 VanDerWaalsContact O-CG 3.29Å; M377-E381 WeakPolarHBondContact O-CG 3.49Å; M377-E381 PolarHBondContact O-N 2.85Å; E381-L384 PolarHBondContact O-N 3.33Å; E381-S385 WeakPolarHBondContact O-CB 3.28Å; E381-S385 PolarHBondContact O-N 3.28Å
382	E	82.9	Confident	83.4	Confident	30 Å²	30	57 Å²	57	14%	0.14	30%	0.3	C	S	.	.	H	α-helix	trans	-63.6	-45.1	175.9	-74	-68.3	141.1	0	0	111.9	R378 A379 A380 L384 S385 N386 F392 T394 L405	R378-E382 WeakPolarHBondContact O-CB 3.45Å; R378-E382 WeakPolarHBondContact O-CG 3.33Å; R378-E382 PolarHBondContact O-N 3.29Å; R378-E382 VanDerWaalsContact O-N 3.07Å; A379-E382 PolarHBondContact O-N 3.11Å; A380-E382 VanDerWaalsContact C-N 3.28Å; A380-E382 PolarHBondContact O-N 3.46Å; E382-L384 PolarHBondContact O-N 3.04Å; E382-S385 PolarHBondContact O-N 3.24Å; E382-N386 VanDerWaalsContact CD-ND2 3.33Å; E382-N386 WeakPolarHBondContact O-CA 3.26Å; E382-N386 WeakPolarHBondContact O-CB 3.39Å; E382-N386 PolarHBondContact O-N 3.06Å; E382-N386 PolarHBondContact OE2-ND2 2.97Å; E382-F392 HydrophobicContact CB-CE2 3.94Å; E382-F392 HydrophobicContact CB-CZ 3.97Å; E382-T394 WeakPolarHBondContact OE2-CB 3.37Å; E382-T394 PolarHBondContact OE2-OG1 2.76Å; E382-L405 HydrophobicContact CB-CD1 4.39Å; E382-L405 HydrophobicContact CG-CD1 3.99Å; E382-L405 HydrophobicContact CG-CD2 4.1Å
383	V	84.2	Confident	82.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-45.1	175.7	169.4	0	0	0	0	111.1	V365 A369 A379 A380 S385 M387 L409 L412 M413	V365-V383 HydrophobicContact CG1-CG1 3.48Å; V365-V383 VanDerWaalsContact CG1-CG1 3.48Å; A369-V383 HydrophobicContact CB-CB 4.06Å; A369-V383 HydrophobicContact CB-CG1 3.77Å; A379-V383 WeakPolarHBondContact O-CG2 2.95Å; A379-V383 PolarHBondContact O-N 3.37Å; A380-V383 PolarHBondContact O-N 2.95Å; V383-S385 VanDerWaalsContact C-N 3.28Å; V383-S385 PolarHBondContact O-N 3Å; V383-M387 HydrophobicContact CG1-CB 4.24Å; V383-M387 HydrophobicContact CG1-SD 4.09Å; V383-M387 WeakPolarHBondContact O-CB 3.46Å; V383-M387 PolarHBondContact O-N 3.24Å; V383-L409 HydrophobicContact CG2-CD2 3.63Å; V383-L412 HydrophobicContact CG2-CD2 4.23Å; V383-M413 HydrophobicContact CG2-SD 4.06Å
384	L	83.7	Confident	81.7	Confident	47 Å²	47	56 Å²	56	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-32.5	-179.7	-70.3	170.4	0	0	0	112.8	Q366 A369 R370 I373 A380 E381 E382	Q366-L384 HydrophobicContact CB-CD2 3.92Å; Q366-L384 HydrophobicContact CG-CD2 4Å; A369-L384 HydrophobicContact CB-CD1 4.5Å; A369-L384 HydrophobicContact CB-CD2 4.01Å; A369-L384 HydrophobicContact CB-CG 3.89Å; R370-L384 HydrophobicContact CG-CD1 4Å; R370-L384 HydrophobicContact CG-CD2 3.95Å; I373-L384 HydrophobicContact CD1-CD1 4.15Å; A380-L384 WeakPolarHBondContact O-CB 3.46Å; A380-L384 WeakPolarHBondContact O-CG 3.37Å; A380-L384 PolarHBondContact O-N 2.84Å; E381-L384 PolarHBondContact O-N 3.33Å; E382-L384 PolarHBondContact O-N 3.04Å
385	S	75.4	Confident	80.8	Confident	80 Å²	80	49.3 Å²	49.3	56%	0.559	27%	0.271	S	S	*	.	H	α-helix	trans	-92	-32.6	-176.9	-176.2	0	0	0	0	113.6	E381 E382 V383	E381-S385 WeakPolarHBondContact O-CB 3.28Å; E381-S385 PolarHBondContact O-N 3.28Å; E382-S385 PolarHBondContact O-N 3.24Å; V383-S385 VanDerWaalsContact C-N 3.28Å; V383-S385 PolarHBondContact O-N 3Å
386	N	72.9	Confident	79.7	Confident	14 Å²	14	46.4 Å²	46.4	8%	0.075	25%	0.254	C	S	.	.	H	α-helix	trans	-129.5	2.1	-159.9	-59	-35.5	0	0	0	114.3	R231 E382 F392 L393	R231-N386 WeakPolarHBondContact CD-OD1 3.21Å; R231-N386 PolarHBondContact NH1-OD1 2.86Å; E382-N386 VanDerWaalsContact CD-ND2 3.33Å; E382-N386 WeakPolarHBondContact O-CA 3.26Å; E382-N386 WeakPolarHBondContact O-CB 3.39Å; E382-N386 PolarHBondContact O-N 3.06Å; E382-N386 PolarHBondContact OE2-ND2 2.97Å; N386-F392 HydrophobicContact CB-CD2 4.43Å; N386-F392 HydrophobicContact CB-CE2 4.1Å; N386-L393 WeakPolarHBondContact CB-O 3.37Å; N386-L393 PolarHBondContact O-N 3.09Å
387	M	75.2	Confident	78.8	Confident	31 Å²	31	48.3 Å²	48.3	15%	0.153	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.3	171.6	-166.5	155	173.4	0	0	111.1	V365 V383 A391 F392 M413	V365-M387 HydrophobicContact CG1-CE 4.05Å; V365-M387 HydrophobicContact CG1-CG 4.41Å; V365-M387 HydrophobicContact CG1-SD 3.52Å; V365-M387 VanDerWaalsContact CG1-SD 3.52Å; V365-M387 HydrophobicContact CG2-CE 4.17Å; V383-M387 HydrophobicContact CG1-CB 4.24Å; V383-M387 HydrophobicContact CG1-SD 4.09Å; V383-M387 WeakPolarHBondContact O-CB 3.46Å; V383-M387 PolarHBondContact O-N 3.24Å; M387-A391 CarbonylContact C-O 3.57Å; M387-A391 WeakPolarHBondContact CA-O 3.5Å; M387-A391 WeakPolarHBondContact CG-O 3.28Å; M387-F392 HydrophobicContact CB-CD2 4.31Å; M387-M413 HydrophobicContact CE-CE 4.3Å; M387-M413 HydrophobicContact SD-CE 4.22Å
388	S	68.3	Low	78.2	Confident	56 Å²	56	47.4 Å²	47.4	39%	0.392	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110.4	174.2	178.7	0	0	0	0	109	D390 A391	S388-D390 VanDerWaalsContact C-N 3.29Å; S388-D390 PolarHBondContact O-N 3.12Å; S388-A391 PolarHBondContact N-O 2.93Å; S388-A391 PolarHBondContact O-N 2.98Å
389	V	68.6	Low	77.8	Confident	42 Å²	42	46.7 Å²	46.7	26%	0.255	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	-78.9	176.7	-168.9	0	0	0	0	114.2	T358	T358-V389 HydrophobicContact CG2-CB 4.18Å; T358-V389 HydrophobicContact CG2-CG1 3.73Å; T358-V389 HydrophobicContact CG2-CG2 3.36Å
390	D	70.5	Confident	77.3	Confident	122 Å²	122	48.1 Å²	48.1	65%	0.652	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	-0.4	-176.5	65.4	-28.3	0	0	0	114.2	S388	S388-D390 VanDerWaalsContact C-N 3.29Å; S388-D390 PolarHBondContact O-N 3.12Å
391	A	73.5	Confident	76.9	Confident	27 Å²	27	51 Å²	51	22%	0.223	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.8	-177.6	0	0	0	0	0	112.9	M387 S388 L451	M387-A391 CarbonylContact C-O 3.57Å; M387-A391 WeakPolarHBondContact CA-O 3.5Å; M387-A391 WeakPolarHBondContact CG-O 3.28Å; S388-A391 PolarHBondContact N-O 2.93Å; S388-A391 PolarHBondContact O-N 2.98Å; A391-L451 HydrophobicContact CB-CD1 4.42Å; A391-L451 HydrophobicContact CB-CD2 3.62Å; A391-L451 HydrophobicContact CB-CG 4.3Å
392	F	74.6	Confident	76.7	Confident	50 Å²	50	47.1 Å²	47.1	22%	0.219	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	128.5	177.6	172.2	-95.7	0	0	0	109.2	E382 N386 M387 T394 L409	E382-F392 HydrophobicContact CB-CE2 3.94Å; E382-F392 HydrophobicContact CB-CZ 3.97Å; N386-F392 HydrophobicContact CB-CD2 4.43Å; N386-F392 HydrophobicContact CB-CE2 4.1Å; M387-F392 HydrophobicContact CB-CD2 4.31Å; F392-T394 HydrophobicContact CE1-CG2 3.45Å; F392-T394 VanDerWaalsContact CE1-CG2 3.45Å; F392-T394 HydrophobicContact CZ-CG2 3.6Å; F392-L409 HydrophobicContact CD1-CD1 4.25Å; F392-L409 HydrophobicContact CE1-CD1 3.45Å; F392-L409 VanDerWaalsContact CE1-CD1 3.45Å; F392-L409 HydrophobicContact CE2-CD1 4.49Å; F392-L409 HydrophobicContact CE2-CD2 4.33Å; F392-L409 HydrophobicContact CZ-CD1 3.61Å; F392-L409 HydrophobicContact CZ-CD2 4.18Å
393	L	76.4	Confident	76.8	Confident	35 Å²	35	48.9 Å²	48.9	18%	0.183	30%	0.302	C	S	.	.			trans	-132.7	128.4	174.8	-178.5	69.5	0	0	0	110.8	L230 W234 N386 V450	L230-L393 HydrophobicContact CD1-CD2 4.01Å; W234-L393 HydrophobicContact CH2-CB 4.33Å; W234-L393 HydrophobicContact CH2-CD2 3.48Å; W234-L393 VanDerWaalsContact CH2-CD2 3.48Å; W234-L393 HydrophobicContact CZ3-CB 4.37Å; W234-L393 HydrophobicContact CZ3-CD2 3.99Å; N386-L393 WeakPolarHBondContact CB-O 3.37Å; N386-L393 PolarHBondContact O-N 3.09Å; L393-V450 HydrophobicContact CD1-CG1 4.23Å; L393-V450 HydrophobicContact CD2-CG1 4.33Å
394	T	76.1	Confident	76.9	Confident	40 Å²	40	54.6 Å²	54.6	25%	0.245	33%	0.329	C	S	.	.			trans	-142.6	169.3	176	-168.8	0	0	0	0	112.1	E382 F392 L405	E382-T394 WeakPolarHBondContact OE2-CB 3.37Å; E382-T394 PolarHBondContact OE2-OG1 2.76Å; F392-T394 HydrophobicContact CE1-CG2 3.45Å; F392-T394 VanDerWaalsContact CE1-CG2 3.45Å; F392-T394 HydrophobicContact CZ-CG2 3.6Å; T394-L405 HydrophobicContact CG2-CD2 3.81Å
395	S	75.9	Confident	77.1	Confident	39 Å²	39	52.4 Å²	52.4	27%	0.273	32%	0.317	S	S	.	.			trans	-124.9	153	166.4	43.5	0	0	0	0	111.4	N227	N227-S395 WeakPolarHBondContact ND2-CB 3.38Å; N227-S395 PolarHBondContact ND2-OG 3.31Å
396	C	73.2	Confident	77.6	Confident	41 Å²	41	49.3 Å²	49.3	28%	0.277	30%	0.295	S	S	.	.			trans	-127.3	158.4	173.3	-59.4	0	0	0	0	109.5	D398 E401 A402	C396-D398 VanDerWaalsContact C-N 3.34Å; C396-E401 HydrophobicContact CB-CB 4.22Å; C396-A402 HydrophobicContact CB-CB 3.9Å
397	A	75.3	Confident	78.3	Confident	87 Å²	87	52.2 Å²	52.2	72%	0.719	31%	0.311	S	S	*	.	S	Bend	trans	-71.3	-31.1	-179.8	0	0	0	0	0	112.3	E401	A397-E401 WeakPolarHBondContact CB-OE2 3.37Å; A397-E401 PolarHBondContact N-OE2 3.19Å
398	D	79.5	Confident	79.1	Confident	97 Å²	97	53.6 Å²	53.6	52%	0.519	32%	0.317	S	S	.	.	S	Bend	trans	-151.3	169.2	177.5	65.9	69.7	0	0	0	112.5	C396 G400 E401 A402	C396-D398 VanDerWaalsContact C-N 3.34Å; D398-G400 VanDerWaalsContact C-N 3.34Å; D398-G400 PolarHBondContact O-N 3.07Å; D398-G400 WeakPolarHBondContact OD1-CA 3.38Å; D398-G400 PolarHBondContact OD1-N 3.16Å; D398-E401 PolarHBondContact O-N 2.79Å; D398-E401 PolarHBondContact OD1-N 2.98Å; D398-A402 PolarHBondContact O-N 3.29Å; D398-A402 VanDerWaalsContact O-N 3.13Å
399	S	78.9	Confident	80.2	Confident	43 Å²	43	51 Å²	51	30%	0.301	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-36.7	-179.2	-63.1	0	0	0	0	113.4	A402 E403 S427 S429	S399-A402 WeakPolarHBondContact O-CB 3.19Å; S399-A402 PolarHBondContact O-N 2.84Å; S399-E403 VanDerWaalsContact O-CG 3.32Å; S399-E403 WeakPolarHBondContact O-CG 3.47Å; S399-E403 PolarHBondContact O-N 2.7Å; S399-S427 PolarHBondContact OG-OG 2.96Å; S399-S429 VanDerWaalsContact CB-OG 3.3Å; S399-S429 WeakPolarHBondContact CB-OG 3.39Å; S399-S429 PolarHBondContact OG-OG 2.76Å
400	G	80.2	Confident	81.1	Confident	30 Å²	30	53.5 Å²	53.5	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-68.8	-39.6	-179	0	0	0	0	0	111.5	D398 A402 E403 Q404	D398-G400 VanDerWaalsContact C-N 3.34Å; D398-G400 PolarHBondContact O-N 3.07Å; D398-G400 WeakPolarHBondContact OD1-CA 3.38Å; D398-G400 PolarHBondContact OD1-N 3.16Å; G400-A402 VanDerWaalsContact C-N 3.28Å; G400-A402 PolarHBondContact O-N 2.8Å; G400-E403 PolarHBondContact O-N 2.84Å; G400-Q404 WeakPolarHBondContact O-CG 3.28Å; G400-Q404 PolarHBondContact O-N 3.44Å
401	E	82.6	Confident	82.2	Confident	60 Å²	60	52.1 Å²	52.1	28%	0.28	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-37	172.7	-145.8	-144.7	148.2	0	0	111.6	R378 C396 A397 D398 L405	R378-E401 IonicContact CZ-OE1 2.8Å; R378-E401 IonicContact NE-OE1 3.66Å; R378-E401 PolarHBondContact NE-OE1 2.62Å; R378-E401 PolarHBondContact NH1-O 2.87Å; R378-E401 IonicContact NH1-OE1 3.42Å; R378-E401 PolarHBondContact NH2-O 2.77Å; R378-E401 IonicContact NH2-OE1 2.92Å; R378-E401 PolarHBondContact NH2-OE1 3.14Å; R378-E401 IonicContact NH2-OE2 2.75Å; C396-E401 HydrophobicContact CB-CB 4.22Å; A397-E401 WeakPolarHBondContact CB-OE2 3.37Å; A397-E401 PolarHBondContact N-OE2 3.19Å; D398-E401 PolarHBondContact O-N 2.79Å; D398-E401 PolarHBondContact OD1-N 2.98Å; E401-L405 WeakPolarHBondContact O-CB 3.49Å; E401-L405 PolarHBondContact O-N 2.94Å
402	A	82.5	Confident	83.2	Confident	17 Å²	17	50.8 Å²	50.8	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-70.4	-44.7	177	0	0	0	0	0	112.5	C396 D398 S399 G400 Q404 L405 V406 V430	C396-A402 HydrophobicContact CB-CB 3.9Å; D398-A402 PolarHBondContact O-N 3.29Å; D398-A402 VanDerWaalsContact O-N 3.13Å; S399-A402 WeakPolarHBondContact O-CB 3.19Å; S399-A402 PolarHBondContact O-N 2.84Å; G400-A402 VanDerWaalsContact C-N 3.28Å; G400-A402 PolarHBondContact O-N 2.8Å; A402-Q404 VanDerWaalsContact C-N 3.32Å; A402-Q404 PolarHBondContact O-N 2.9Å; A402-L405 PolarHBondContact O-N 3.2Å; A402-L405 VanDerWaalsContact O-N 3.15Å; A402-V406 WeakPolarHBondContact O-CG2 3.49Å; A402-V406 PolarHBondContact O-N 3.11Å; A402-V430 HydrophobicContact CB-CG1 4.46Å; A402-V430 HydrophobicContact CB-CG2 3.95Å
403	E	84.5	Confident	84	Confident	67 Å²	67	48.5 Å²	48.5	31%	0.313	27%	0.271	S	S	.	.	H	α-helix	trans	-58.6	-44.9	177.6	-74.1	168.5	-152.7	0	0	111.3	S399 G400 L405 V406 D407 S429 V430 A433	S399-E403 VanDerWaalsContact O-CG 3.32Å; S399-E403 WeakPolarHBondContact O-CG 3.47Å; S399-E403 PolarHBondContact O-N 2.7Å; G400-E403 PolarHBondContact O-N 2.84Å; E403-L405 PolarHBondContact O-N 3.19Å; E403-V406 PolarHBondContact O-N 3.45Å; E403-D407 PolarHBondContact O-N 3.49Å; E403-D407 VanDerWaalsContact O-N 3.09Å; E403-S429 PolarHBondContact OE1-OG 3.46Å; E403-V430 HydrophobicContact CG-CB 4.46Å; E403-V430 HydrophobicContact CG-CG2 4.06Å; E403-A433 HydrophobicContact CG-CB 3.8Å
404	Q	88	Confident	84.7	Confident	121 Å²	121	53.7 Å²	53.7	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-62.4	-41.8	175.2	-70.1	176.2	13.3	0	0	112.3	G400 A402 D407 Q408	G400-Q404 WeakPolarHBondContact O-CG 3.28Å; G400-Q404 PolarHBondContact O-N 3.44Å; A402-Q404 VanDerWaalsContact C-N 3.32Å; A402-Q404 PolarHBondContact O-N 2.9Å; Q404-D407 PolarHBondContact O-N 2.8Å; Q404-Q408 WeakPolarHBondContact O-CG 3.44Å; Q404-Q408 PolarHBondContact O-N 2.91Å
405	L	87	Confident	85.4	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-42.1	179.2	179.2	57.1	0	0	0	111.3	R378 A379 E382 T394 E401 A402 E403 Q408 L409	R378-L405 HydrophobicContact CG-CD1 4.28Å; A379-L405 HydrophobicContact CB-CD1 4.19Å; E382-L405 HydrophobicContact CB-CD1 4.39Å; E382-L405 HydrophobicContact CG-CD1 3.99Å; E382-L405 HydrophobicContact CG-CD2 4.1Å; T394-L405 HydrophobicContact CG2-CD2 3.81Å; E401-L405 WeakPolarHBondContact O-CB 3.49Å; E401-L405 PolarHBondContact O-N 2.94Å; A402-L405 PolarHBondContact O-N 3.2Å; A402-L405 VanDerWaalsContact O-N 3.15Å; E403-L405 PolarHBondContact O-N 3.19Å; L405-Q408 PolarHBondContact O-N 3.2Å; L405-L409 HydrophobicContact CD1-CD1 4.12Å; L405-L409 HydrophobicContact CD1-CG 4.1Å; L405-L409 HydrophobicContact CG-CD1 3.85Å; L405-L409 HydrophobicContact CG-CG 4.32Å; L405-L409 WeakPolarHBondContact O-CB 3.31Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.2Å; L405-L409 PolarHBondContact O-N 3.14Å
406	V	85.9	Confident	86.1	Confident	15 Å²	15	53.7 Å²	53.7	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-41	179.2	174.8	0	0	0	0	111.8	A402 E403 L409 R410 W423 I434	A402-V406 WeakPolarHBondContact O-CG2 3.49Å; A402-V406 PolarHBondContact O-N 3.11Å; E403-V406 PolarHBondContact O-N 3.45Å; V406-L409 PolarHBondContact O-N 2.83Å; V406-R410 WeakPolarHBondContact O-CG 3.28Å; V406-R410 PolarHBondContact O-N 2.69Å; V406-W423 HydrophobicContact CB-CH2 4.4Å; V406-W423 HydrophobicContact CB-CZ3 4.3Å; V406-W423 HydrophobicContact CG1-CE3 4.2Å; V406-W423 HydrophobicContact CG1-CH2 3.68Å; V406-W423 HydrophobicContact CG1-CZ2 4.05Å; V406-W423 HydrophobicContact CG1-CZ3 3.78Å; V406-W423 HydrophobicContact CG2-CE3 4.33Å; V406-W423 HydrophobicContact CG2-CH2 4.3Å; V406-W423 HydrophobicContact CG2-CZ3 3.75Å; V406-I434 HydrophobicContact CB-CD1 4.16Å; V406-I434 HydrophobicContact CB-CG1 4.19Å; V406-I434 HydrophobicContact CG1-CD1 3.8Å; V406-I434 HydrophobicContact CG1-CG1 3.62Å; V406-I434 HydrophobicContact CG1-CG2 4.06Å; V406-I434 HydrophobicContact CG2-CD1 3.8Å; V406-I434 HydrophobicContact CG2-CG1 4.38Å
407	D	88.4	Confident	86.8	Confident	75 Å²	75	53.7 Å²	53.7	40%	0.401	30%	0.296	S	S	.	.	H	α-helix	trans	-60.5	-45.2	173.8	177.6	67.1	0	0	0	111.7	E403 Q404 R410 K411	E403-D407 PolarHBondContact O-N 3.49Å; E403-D407 VanDerWaalsContact O-N 3.09Å; Q404-D407 PolarHBondContact O-N 2.8Å; D407-R410 PolarHBondContact O-N 3.43Å; D407-K411 VanDerWaalsContact CG-NZ 3.31Å; D407-K411 WeakPolarHBondContact O-CG 3.03Å; D407-K411 PolarHBondContact O-N 2.9Å; D407-K411 VanDerWaalsContact O-N 3.09Å; D407-K411 WeakPolarHBondContact OD1-CE 3.14Å; D407-K411 IonicContact OD1-NZ 2.64Å; D407-K411 PolarHBondContact OD1-NZ 2.85Å; D407-K411 WeakPolarHBondContact OD2-CE 3.2Å; D407-K411 IonicContact OD2-NZ 3.07Å; D407-K411 PolarHBondContact OD2-NZ 2.9Å
408	Q	91.8	Very high	87.5	Confident	60 Å²	60	52.4 Å²	52.4	28%	0.28	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-42.8	176.1	-71.6	-174.5	1.7	0	0	112.5	Y376 A379 Q404 L405 K411 L412	Y376-Q408 HydrophobicContact CD1-CB 4.41Å; A379-Q408 HydrophobicContact CB-CB 3.7Å; Q404-Q408 WeakPolarHBondContact O-CG 3.44Å; Q404-Q408 PolarHBondContact O-N 2.91Å; L405-Q408 PolarHBondContact O-N 3.2Å; Q408-K411 PolarHBondContact O-N 3.35Å; Q408-L412 VanDerWaalsContact O-CB 3.23Å; Q408-L412 WeakPolarHBondContact O-CB 3.35Å; Q408-L412 PolarHBondContact O-N 2.91Å
409	L	90	Very high	87.7	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-44.1	177.5	-78	166.5	0	0	0	111.7	A379 V383 F392 L405 V406 M413 L420 W423	A379-L409 HydrophobicContact CB-CD2 3.94Å; A379-L409 HydrophobicContact CB-CG 4.02Å; V383-L409 HydrophobicContact CG2-CD2 3.63Å; F392-L409 HydrophobicContact CD1-CD1 4.25Å; F392-L409 HydrophobicContact CE1-CD1 3.45Å; F392-L409 VanDerWaalsContact CE1-CD1 3.45Å; F392-L409 HydrophobicContact CE2-CD1 4.49Å; F392-L409 HydrophobicContact CE2-CD2 4.33Å; F392-L409 HydrophobicContact CZ-CD1 3.61Å; F392-L409 HydrophobicContact CZ-CD2 4.18Å; L405-L409 HydrophobicContact CD1-CD1 4.12Å; L405-L409 HydrophobicContact CD1-CG 4.1Å; L405-L409 HydrophobicContact CG-CD1 3.85Å; L405-L409 HydrophobicContact CG-CG 4.32Å; L405-L409 WeakPolarHBondContact O-CB 3.31Å; L405-L409 VanDerWaalsContact O-CG 3.3Å; L405-L409 WeakPolarHBondContact O-CG 3.2Å; L405-L409 PolarHBondContact O-N 3.14Å; V406-L409 PolarHBondContact O-N 2.83Å; L409-M413 VanDerWaalsContact O-CB 3.27Å; L409-M413 WeakPolarHBondContact O-CB 3.22Å; L409-M413 WeakPolarHBondContact O-CG 3.45Å; L409-M413 PolarHBondContact O-N 2.71Å; L409-L420 HydrophobicContact CB-CD1 4.04Å; L409-W423 HydrophobicContact CB-CH2 4.29Å; L409-W423 HydrophobicContact CD1-CH2 4.34Å
410	R	88.7	Confident	87.8	Confident	94 Å²	94	54.1 Å²	54.1	36%	0.355	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-50.3	176.1	-79.1	176.1	163.7	-179.5	-8.9	111.3	V406 D407 Q414 W423 I434	V406-R410 WeakPolarHBondContact O-CG 3.28Å; V406-R410 PolarHBondContact O-N 2.69Å; D407-R410 PolarHBondContact O-N 3.43Å; R410-Q414 WeakPolarHBondContact O-CB 3.47Å; R410-Q414 PolarHBondContact O-N 2.74Å; R410-W423 HydrophobicContact CG-CZ2 4.02Å; R410-I434 PolarHBondContact NH1-O 3.3Å; R410-I434 PolarHBondContact NH2-O 3.49Å
411	K	93.4	Very high	87.9	Confident	92 Å²	92	57 Å²	57	40%	0.4	29%	0.292	S	S	.	.	H	α-helix	trans	-62.1	-47.6	-179.8	-72.5	170	179.9	167.2	0	111.6	Y376 D407 Q408 L415	Y376-K411 HydrophobicContact CE1-CB 3.74Å; Y376-K411 HydrophobicContact CE1-CD 4.43Å; D407-K411 VanDerWaalsContact CG-NZ 3.31Å; D407-K411 WeakPolarHBondContact O-CG 3.03Å; D407-K411 PolarHBondContact O-N 2.9Å; D407-K411 VanDerWaalsContact O-N 3.09Å; D407-K411 WeakPolarHBondContact OD1-CE 3.14Å; D407-K411 IonicContact OD1-NZ 2.64Å; D407-K411 PolarHBondContact OD1-NZ 2.85Å; D407-K411 WeakPolarHBondContact OD2-CE 3.2Å; D407-K411 IonicContact OD2-NZ 3.07Å; D407-K411 PolarHBondContact OD2-NZ 2.9Å; Q408-K411 PolarHBondContact O-N 3.35Å; K411-L415 WeakPolarHBondContact O-CG 2.96Å; K411-L415 PolarHBondContact O-N 3.1Å
412	L	93.4	Very high	87.6	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-55.2	-61.6	176.1	171.9	59.4	0	0	0	110	H368 H372 Y376 A379 A380 V383 Q408 Q414 L415	H368-L412 PolarHBondContact NE2-O 3.09Å; H372-L412 HydrophobicContact CB-CD1 3.45Å; H372-L412 VanDerWaalsContact CB-CD1 3.45Å; Y376-L412 HydrophobicContact CD2-CB 4.25Å; Y376-L412 HydrophobicContact CD2-CD1 4.07Å; Y376-L412 HydrophobicContact CG-CB 4.11Å; Y376-L412 HydrophobicContact CG-CD1 4.47Å; A379-L412 HydrophobicContact CB-CD2 3.95Å; A380-L412 HydrophobicContact CB-CD2 4.16Å; V383-L412 HydrophobicContact CG2-CD2 4.23Å; Q408-L412 VanDerWaalsContact O-CB 3.23Å; Q408-L412 WeakPolarHBondContact O-CB 3.35Å; Q408-L412 PolarHBondContact O-N 2.91Å; L412-Q414 VanDerWaalsContact C-N 3.28Å; L412-Q414 PolarHBondContact O-N 3.35Å; L412-L415 WeakPolarHBondContact O-CB 3.4Å; L412-L415 PolarHBondContact O-N 2.89Å
413	M	91.8	Very high	87.4	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-32.4	-172.9	-64.6	-53.6	-73.3	0	0	112.7	V365 V383 M387 L409 L415 G416 G417 F418 L420	V365-M413 HydrophobicContact CG1-CE 4.18Å; V365-M413 HydrophobicContact CG2-CE 4.46Å; V383-M413 HydrophobicContact CG2-SD 4.06Å; M387-M413 HydrophobicContact CE-CE 4.3Å; M387-M413 HydrophobicContact SD-CE 4.22Å; L409-M413 VanDerWaalsContact O-CB 3.27Å; L409-M413 WeakPolarHBondContact O-CB 3.22Å; L409-M413 WeakPolarHBondContact O-CG 3.45Å; L409-M413 PolarHBondContact O-N 2.71Å; M413-L415 VanDerWaalsContact C-N 3.3Å; M413-L415 PolarHBondContact O-N 3.5Å; M413-G416 PolarHBondContact O-N 2.85Å; M413-G416 VanDerWaalsContact O-N 3.1Å; M413-G417 PolarHBondContact O-N 3.01Å; M413-F418 CarbonylContact C-O 3.57Å; M413-F418 HydrophobicContact CB-CB 4.02Å; M413-F418 HydrophobicContact CE-CB 3.8Å; M413-F418 HydrophobicContact CE-CD2 3.79Å; M413-F418 HydrophobicContact CE-CG 3.93Å; M413-F418 WeakPolarHBondContact O-CB 3.49Å; M413-F418 PolarHBondContact O-N 3.04Å; M413-L420 HydrophobicContact CB-CD1 4.22Å; M413-L420 HydrophobicContact CB-CG 4.06Å; M413-L420 HydrophobicContact CG-CD1 3.77Å; M413-L420 HydrophobicContact CG-CD2 4.26Å; M413-L420 HydrophobicContact CG-CG 3.97Å
414	Q	91.3	Very high	86.9	Confident	143 Å²	143	65.1 Å²	65.1	67%	0.668	32%	0.321	S	S	*	.	H	α-helix	trans	-64.3	-31.7	175.7	-174	172.5	18.5	0	0	112.8	R410 L412 G416 G417	R410-Q414 WeakPolarHBondContact O-CB 3.47Å; R410-Q414 PolarHBondContact O-N 2.74Å; L412-Q414 VanDerWaalsContact C-N 3.28Å; L412-Q414 PolarHBondContact O-N 3.35Å; Q414-G416 PolarHBondContact O-N 3.22Å; Q414-G417 PolarHBondContact O-N 2.86Å
415	L	91.9	Very high	86.3	Confident	77 Å²	77	60.6 Å²	60.6	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-61.2	-27.7	174.5	-68.4	171.4	0	0	0	112.3	F265 Y376 K411 L412 M413	F265-L415 WeakPolarHBondContact CZ-O 3.5Å; Y376-L415 HydrophobicContact CD2-CD1 4.44Å; Y376-L415 HydrophobicContact CE2-CD1 3.57Å; K411-L415 WeakPolarHBondContact O-CG 2.96Å; K411-L415 PolarHBondContact O-N 3.1Å; L412-L415 WeakPolarHBondContact O-CB 3.4Å; L412-L415 PolarHBondContact O-N 2.89Å; M413-L415 VanDerWaalsContact C-N 3.3Å; M413-L415 PolarHBondContact O-N 3.5Å
416	G	90.3	Very high	85.6	Confident	2 Å²	2	64.6 Å²	64.6	2%	0.021	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	3.1	175.8	0	0	0	0	0	114.4	H368 M413 Q414 F418	H368-G416 WeakPolarHBondContact CE1-CA 3.33Å; H368-G416 PolarHBondContact CE1-N 2.81Å; H368-G416 PolarHBondContact NE2-N 2.78Å; M413-G416 PolarHBondContact O-N 2.85Å; M413-G416 VanDerWaalsContact O-N 3.1Å; Q414-G416 PolarHBondContact O-N 3.22Å; G416-F418 VanDerWaalsContact C-N 3.28Å
417	G	88.4	Confident	85	Confident	41 Å²	41	65 Å²	65	42%	0.423	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	12.5	-172.5	0	0	0	0	0	114.4	E268 M413 Q414	E268-G417 WeakPolarHBondContact O-CA 3.31Å; M413-G417 PolarHBondContact O-N 3.01Å; Q414-G417 PolarHBondContact O-N 2.86Å
418	F	88.4	Confident	84.3	Confident	61 Å²	61	65.7 Å²	65.7	27%	0.268	34%	0.338	S	S	.	.			trans	-89.8	114.3	-180	-54.7	-66.7	0	0	0	110.9	Y270 V364 V365 H368 M413 G416	Y270-F418 HydrophobicContact CD2-CE2 4.1Å; Y270-F418 AromaticContact CD2-CZ 3.88Å; Y270-F418 HydrophobicContact CD2-CZ 3.88Å; Y270-F418 AromaticContact CE2-CE2 3.93Å; Y270-F418 HydrophobicContact CE2-CE2 3.93Å; Y270-F418 HydrophobicContact CE2-CZ 4.19Å; V364-F418 HydrophobicContact CG1-CZ 3.8Å; V365-F418 HydrophobicContact CG2-CE1 4.5Å; V365-F418 HydrophobicContact CG2-CZ 4.33Å; H368-F418 HydrophobicContact CB-CE2 4.27Å; M413-F418 CarbonylContact C-O 3.57Å; M413-F418 HydrophobicContact CB-CB 4.02Å; M413-F418 HydrophobicContact CE-CB 3.8Å; M413-F418 HydrophobicContact CE-CD2 3.79Å; M413-F418 HydrophobicContact CE-CG 3.93Å; M413-F418 WeakPolarHBondContact O-CB 3.49Å; M413-F418 PolarHBondContact O-N 3.04Å; G416-F418 VanDerWaalsContact C-N 3.28Å
419	N	83.9	Confident	83.5	Confident	137 Å²	137	64.9 Å²	64.9	73%	0.733	34%	0.339	S	S	*	.			trans	-92	104.7	174.7	-170.3	14.2	0	0	0	110.7	T421	N419-T421 PolarHBondContact O-N 2.85Å
420	L	82.2	Confident	82.9	Confident	38 Å²	38	65.1 Å²	65.1	20%	0.199	34%	0.34	C	S	.	.			trans	-69.3	119	173.9	-66.6	-179.7	0	0	0	110.2	L409 M413 W423	L409-L420 HydrophobicContact CB-CD1 4.04Å; M413-L420 HydrophobicContact CB-CD1 4.22Å; M413-L420 HydrophobicContact CB-CG 4.06Å; M413-L420 HydrophobicContact CG-CD1 3.77Å; M413-L420 HydrophobicContact CG-CD2 4.26Å; M413-L420 HydrophobicContact CG-CG 3.97Å; L420-W423 HydrophobicContact CB-CH2 4.36Å; L420-W423 HydrophobicContact CB-CZ2 3.47Å; L420-W423 VanDerWaalsContact CB-CZ2 3.47Å; L420-W423 HydrophobicContact CD1-CH2 3.68Å; L420-W423 HydrophobicContact CD1-CZ2 3.54Å; L420-W423 HydrophobicContact CG-CZ2 4.17Å; L420-W423 PolarHBondContact O-NE1 2.84Å
421	T	80.6	Confident	82.2	Confident	91 Å²	91	61 Å²	61	56%	0.558	33%	0.326	S	S	*	.			trans	-125.1	174.8	-177.4	59	0	0	0	0	111	N419 W423	N419-T421 PolarHBondContact O-N 2.85Å; T421-W423 VanDerWaalsContact C-N 3.3Å; T421-W423 PolarHBondContact O-N 2.83Å
422	K	77.4	Confident	81.4	Confident	176 Å²	176	63.8 Å²	63.8	77%	0.765	34%	0.341	S	S	*	.	S	Bend	trans	57.5	38.9	176.9	-53.9	178.6	-178.7	176.3	0	113.9
423	W	78.7	Confident	80.3	Confident	41 Å²	41	66.4 Å²	66.4	16%	0.155	36%	0.362	C	S	.	.			trans	-58.2	139.2	176.4	-68.6	90.9	0	0	0	111.6	V406 L409 R410 L420 T421 I434 V436	V406-W423 HydrophobicContact CB-CH2 4.4Å; V406-W423 HydrophobicContact CB-CZ3 4.3Å; V406-W423 HydrophobicContact CG1-CE3 4.2Å; V406-W423 HydrophobicContact CG1-CH2 3.68Å; V406-W423 HydrophobicContact CG1-CZ2 4.05Å; V406-W423 HydrophobicContact CG1-CZ3 3.78Å; V406-W423 HydrophobicContact CG2-CE3 4.33Å; V406-W423 HydrophobicContact CG2-CH2 4.3Å; V406-W423 HydrophobicContact CG2-CZ3 3.75Å; L409-W423 HydrophobicContact CB-CH2 4.29Å; L409-W423 HydrophobicContact CD1-CH2 4.34Å; R410-W423 HydrophobicContact CG-CZ2 4.02Å; L420-W423 HydrophobicContact CB-CH2 4.36Å; L420-W423 HydrophobicContact CB-CZ2 3.47Å; L420-W423 VanDerWaalsContact CB-CZ2 3.47Å; L420-W423 HydrophobicContact CD1-CH2 3.68Å; L420-W423 HydrophobicContact CD1-CZ2 3.54Å; L420-W423 HydrophobicContact CG-CZ2 4.17Å; L420-W423 PolarHBondContact O-NE1 2.84Å; T421-W423 VanDerWaalsContact C-N 3.3Å; T421-W423 PolarHBondContact O-N 2.83Å; W423-I434 HydrophobicContact CB-CG2 4.28Å; W423-I434 HydrophobicContact CD2-CG2 4.14Å; W423-I434 HydrophobicContact CG-CG2 3.94Å; W423-V436 HydrophobicContact CB-CG1 4.42Å; W423-V436 HydrophobicContact CB-CG2 3.66Å; W423-V436 HydrophobicContact CG-CG2 4.25Å
424	K	74.2	Confident	79.4	Confident	98 Å²	98	66.6 Å²	66.6	43%	0.426	36%	0.363	S	S	.	.			trans	-136.4	136.7	175.6	-61.4	178.7	-178	-171.3	0	109.2	S448 E449 W455	K424-S448 WeakPolarHBondContact CD-OG 3.35Å; K424-S448 VanDerWaalsContact CE-OG 3.25Å; K424-S448 WeakPolarHBondContact CE-OG 3.44Å; K424-S448 PolarHBondContact NZ-OG 3.33Å; K424-E449 PolarHBondContact NZ-O 2.97Å; K424-W455 HydrophobicContact CB-CZ3 4.03Å
425	C	74.6	Confident	78.3	Confident	25 Å²	25	70.5 Å²	70.5	17%	0.169	37%	0.372	C	S	.	.			trans	-151.4	157.5	177	61	0	0	0	0	111.3	S427 V430	C425-S427 PolarHBondContact SG-O 2.89Å; C425-V430 HydrophobicContact CB-CG1 4.12Å
426	N	72.7	Confident	76.6	Confident	87 Å²	87	68.1 Å²	68.1	47%	0.465	36%	0.361	S	S	.	.	S	Bend	trans	-97.2	6.3	177.7	64.2	-12.4	0	0	0	113.4	W455	N426-W455 HydrophobicContact CB-CH2 4.39Å; N426-W455 HydrophobicContact CB-CZ2 3.9Å
427	S	73	Confident	74.4	Confident	23 Å²	23	74.4 Å²	74.4	16%	0.161	40%	0.399	C	S	.	.			trans	-114.7	127.1	178.8	173	0	0	0	0	110.4	S399 C425 S429 V430 A431	S399-S427 PolarHBondContact OG-OG 2.96Å; C425-S427 PolarHBondContact SG-O 2.89Å; S427-S429 PolarHBondContact OG-OG 2.84Å; S427-V430 PolarHBondContact O-N 3.18Å; S427-V430 WeakPolarHBondContact OG-CG2 3.41Å; S427-A431 WeakPolarHBondContact O-CB 3.35Å; S427-A431 PolarHBondContact O-N 2.96Å
428	S	73.5	Confident	72.2	Confident	89 Å²	89	78.2 Å²	78.2	62%	0.622	41%	0.409	S	S	*	.	H	α-helix	trans	-66.9	-36.8	177.9	54.6	0	0	0	0	112.4	A431 E432	S428-A431 WeakPolarHBondContact O-CB 3.39Å; S428-A431 PolarHBondContact O-N 3.04Å; S428-E432 WeakPolarHBondContact O-CG 3.46Å; S428-E432 PolarHBondContact O-N 3.41Å
429	S	75.7	Confident	69.9	Low	43 Å²	43	77.2 Å²	77.2	30%	0.301	41%	0.408	S	S	.	.	H	α-helix	trans	-65	-42.9	177.6	77	0	0	0	0	111.3	S399 E403 S427 E432 A433	S399-S429 VanDerWaalsContact CB-OG 3.3Å; S399-S429 WeakPolarHBondContact CB-OG 3.39Å; S399-S429 PolarHBondContact OG-OG 2.76Å; E403-S429 PolarHBondContact OE1-OG 3.46Å; S427-S429 PolarHBondContact OG-OG 2.84Å; S429-E432 PolarHBondContact O-N 3.1Å; S429-A433 WeakPolarHBondContact O-CB 3.4Å; S429-A433 PolarHBondContact O-N 2.89Å
430	V	76.4	Confident	67.8	Low	7 Å²	7	74 Å²	74	4%	0.042	39%	0.394	C	S	.	.	H	α-helix	trans	-64.2	-45.1	176.9	178.4	0	0	0	0	109.8	A402 E403 C425 S427 E432 A433 I434	A402-V430 HydrophobicContact CB-CG1 4.46Å; A402-V430 HydrophobicContact CB-CG2 3.95Å; E403-V430 HydrophobicContact CG-CB 4.46Å; E403-V430 HydrophobicContact CG-CG2 4.06Å; C425-V430 HydrophobicContact CB-CG1 4.12Å; S427-V430 PolarHBondContact O-N 3.18Å; S427-V430 WeakPolarHBondContact OG-CG2 3.41Å; V430-E432 VanDerWaalsContact C-N 3.35Å; V430-E432 PolarHBondContact O-N 2.85Å; V430-A433 PolarHBondContact O-N 3.49Å; V430-I434 HydrophobicContact CG1-CD1 3.43Å; V430-I434 VanDerWaalsContact CG1-CD1 3.43Å; V430-I434 HydrophobicContact CG1-CG1 4.24Å; V430-I434 WeakPolarHBondContact O-CD1 3.38Å; V430-I434 WeakPolarHBondContact O-CG1 3.47Å; V430-I434 PolarHBondContact O-N 3.12Å
431	A	74.5	Confident	65.6	Low	7 Å²	7	76 Å²	76	6%	0.058	42%	0.416	C	S	.	.	H	α-helix	trans	-54	-48.1	174.9	0	0	0	0	0	113	S427 S428 I434 R435 V436 V439	S427-A431 WeakPolarHBondContact O-CB 3.35Å; S427-A431 PolarHBondContact O-N 2.96Å; S428-A431 WeakPolarHBondContact O-CB 3.39Å; S428-A431 PolarHBondContact O-N 3.04Å; A431-I434 PolarHBondContact O-N 3.08Å; A431-R435 PolarHBondContact O-N 2.83Å; A431-V436 PolarHBondContact O-N 3.25Å; A431-V439 HydrophobicContact CB-CB 3.98Å; A431-V439 HydrophobicContact CB-CG1 3.69Å; A431-V439 HydrophobicContact CB-CG2 3.27Å
432	E	75.6	Confident	63.4	Low	152 Å²	152	77.8 Å²	77.8	71%	0.71	42%	0.422	S	S	*	.	H	α-helix	trans	-63.1	-46.5	177	-74.8	174.7	-167.9	0	0	111.7	S428 S429 V430 I434 R435	S428-E432 WeakPolarHBondContact O-CG 3.46Å; S428-E432 PolarHBondContact O-N 3.41Å; S429-E432 PolarHBondContact O-N 3.1Å; V430-E432 VanDerWaalsContact C-N 3.35Å; V430-E432 PolarHBondContact O-N 2.85Å; E432-I434 VanDerWaalsContact C-N 3.3Å; E432-I434 PolarHBondContact O-N 3.42Å; E432-R435 PolarHBondContact O-N 3.16Å
433	A	72	Confident	61.6	Low	54 Å²	54	76.8 Å²	76.8	45%	0.446	43%	0.425	S	S	.	.	H	α-helix	trans	-60.8	-37.6	179.5	0	0	0	0	0	112.6	E403 S429 V430 R435	E403-A433 HydrophobicContact CG-CB 3.8Å; S429-A433 WeakPolarHBondContact O-CB 3.4Å; S429-A433 PolarHBondContact O-N 2.89Å; V430-A433 PolarHBondContact O-N 3.49Å; A433-R435 VanDerWaalsContact C-N 3.25Å; A433-R435 PolarHBondContact O-N 2.85Å
434	I	71.6	Confident	59.8	Low	7 Å²	7	81.2 Å²	81.2	4%	0.036	45%	0.452	C	S	.	.	H	α-helix	trans	-79	-12.1	-179.4	-55.4	167.5	0	0	0	111.1	V406 R410 W423 V430 A431 E432 V436	V406-I434 HydrophobicContact CB-CD1 4.16Å; V406-I434 HydrophobicContact CB-CG1 4.19Å; V406-I434 HydrophobicContact CG1-CD1 3.8Å; V406-I434 HydrophobicContact CG1-CG1 3.62Å; V406-I434 HydrophobicContact CG1-CG2 4.06Å; V406-I434 HydrophobicContact CG2-CD1 3.8Å; V406-I434 HydrophobicContact CG2-CG1 4.38Å; R410-I434 PolarHBondContact NH1-O 3.3Å; R410-I434 PolarHBondContact NH2-O 3.49Å; W423-I434 HydrophobicContact CB-CG2 4.28Å; W423-I434 HydrophobicContact CD2-CG2 4.14Å; W423-I434 HydrophobicContact CG-CG2 3.94Å; V430-I434 HydrophobicContact CG1-CD1 3.43Å; V430-I434 VanDerWaalsContact CG1-CD1 3.43Å; V430-I434 HydrophobicContact CG1-CG1 4.24Å; V430-I434 WeakPolarHBondContact O-CD1 3.38Å; V430-I434 WeakPolarHBondContact O-CG1 3.47Å; V430-I434 PolarHBondContact O-N 3.12Å; A431-I434 PolarHBondContact O-N 3.08Å; E432-I434 VanDerWaalsContact C-N 3.3Å; E432-I434 PolarHBondContact O-N 3.42Å; I434-V436 VanDerWaalsContact C-N 3.31Å; I434-V436 HydrophobicContact CB-CG2 3.72Å; I434-V436 HydrophobicContact CG2-CG2 3.29Å
435	R	68.5	Low	58.3	Low	224 Å²	224	86.9 Å²	86.9	85%	0.845	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	39.8	-175	-56.7	-179	179.3	170.7	-0.4	113.1	A431 E432 A433	A431-R435 PolarHBondContact O-N 2.83Å; E432-R435 PolarHBondContact O-N 3.16Å; A433-R435 VanDerWaalsContact C-N 3.25Å; A433-R435 PolarHBondContact O-N 2.85Å
436	V	56.1	Low	57.2	Low	28 Å²	28	88.4 Å²	88.4	17%	0.17	48%	0.476	C	S	.	.			trans	-90.7	113.6	-179.7	-175.2	0	0	0	0	108.2	W423 A431 I434 D438 V439	W423-V436 HydrophobicContact CB-CG1 4.42Å; W423-V436 HydrophobicContact CB-CG2 3.66Å; W423-V436 HydrophobicContact CG-CG2 4.25Å; A431-V436 PolarHBondContact O-N 3.25Å; I434-V436 VanDerWaalsContact C-N 3.31Å; I434-V436 HydrophobicContact CB-CG2 3.72Å; I434-V436 HydrophobicContact CG2-CG2 3.29Å; V436-D438 VanDerWaalsContact C-N 3.27Å; V436-D438 HydrophobicContact CG1-CB 3.94Å; V436-V439 HydrophobicContact CB-CG2 3.86Å; V436-V439 HydrophobicContact CG1-CG2 4.1Å; V436-V439 VanDerWaalsContact O-CG2 3.24Å; V436-V439 WeakPolarHBondContact O-CG2 3.46Å
437	T	44	Very low	56	Low	134 Å²	134	88.4 Å²	88.4	82%	0.822	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-21.3	172.5	47.8	0	0	0	0	112.6	V439	T437-V439 PolarHBondContact O-N 3.29Å; T437-V439 VanDerWaalsContact O-N 3.16Å
438	D	42.6	Very low	55.1	Low	121 Å²	121	88.2 Å²	88.2	65%	0.647	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	9.6	176.7	-71.7	-14.7	0	0	0	113.5	V436 T440	V436-D438 VanDerWaalsContact C-N 3.27Å; V436-D438 HydrophobicContact CG1-CB 3.94Å; D438-T440 PolarHBondContact O-N 3.48Å
439	V	40.8	Very low	54.3	Low	40 Å²	40	90.1 Å²	90.1	24%	0.242	48%	0.477	C	S	.	.			trans	-70.1	97	164.8	-178.7	0	0	0	0	104.7	A431 V436 T437 A441	A431-V439 HydrophobicContact CB-CB 3.98Å; A431-V439 HydrophobicContact CB-CG1 3.69Å; A431-V439 HydrophobicContact CB-CG2 3.27Å; V436-V439 HydrophobicContact CB-CG2 3.86Å; V436-V439 HydrophobicContact CG1-CG2 4.1Å; V436-V439 VanDerWaalsContact O-CG2 3.24Å; V436-V439 WeakPolarHBondContact O-CG2 3.46Å; T437-V439 PolarHBondContact O-N 3.29Å; T437-V439 VanDerWaalsContact O-N 3.16Å; V439-A441 HydrophobicContact CG1-CB 4.22Å; V439-A441 PolarHBondContact O-N 3.38Å
440	T	39.6	Very low	53.5	Low	69 Å²	69	89.3 Å²	89.3	42%	0.423	47%	0.47	S	S	.	.			trans	-65.6	78	169.6	55.2	0	0	0	0	107.7	D438 N442 I446	D438-T440 PolarHBondContact O-N 3.48Å; T440-N442 PolarHBondContact O-N 3.01Å; T440-I446 VanDerWaalsContact CB-CD1 3.45Å; T440-I446 HydrophobicContact CG2-CD1 4.25Å
441	A	34.9	Very low	52.7	Low	80 Å²	80	92.6 Å²	92.6	66%	0.661	49%	0.487	S	S	*	.			trans	-75.4	30.9	-175.3	0	0	0	0	0	112.4	V439	V439-A441 HydrophobicContact CG1-CB 4.22Å; V439-A441 PolarHBondContact O-N 3.38Å
442	N	35.2	Very low	52.2	Low	128 Å²	128	94.9 Å²	94.9	68%	0.684	51%	0.511	S	S	*	.			trans	-99	112.4	171.3	-90.3	-6.6	0	0	0	108.4	T440 D444 I446	T440-N442 PolarHBondContact O-N 3.01Å; N442-D444 PolarHBondContact O-N 3.18Å; N442-I446 HydrophobicContact CB-CD1 4.13Å
443	N	40.4	Very low	51.5	Low	156 Å²	156	89 Å²	89	83%	0.834	49%	0.485	S	S	*	.	S	Bend	trans	-55.3	6.9	-180	-82	-29.9	0	0	0	116
444	D	39.6	Very low	51.1	Low	134 Å²	134	88.6 Å²	88.6	72%	0.717	48%	0.478	S	S	*	.	S	Bend	trans	-113.3	97.7	-179.1	-73.9	-35.2	0	0	0	110.9	N442 I446	N442-D444 PolarHBondContact O-N 3.18Å; D444-I446 VanDerWaalsContact C-N 3.34Å; D444-I446 WeakPolarHBondContact O-CG1 3.36Å; D444-I446 PolarHBondContact O-N 2.73Å
445	R	43.7	Very low	50.7	Low	217 Å²	217	89.6 Å²	89.6	82%	0.819	48%	0.482	S	S	*	.			trans	55.5	35.3	151.3	-61.8	178.9	163.5	171.9	-3.8	116.7	V447	R445-V447 PolarHBondContact O-N 2.81Å; R445-V447 VanDerWaalsContact O-N 3.08Å
446	I	50.2	Low	50.5	Low	56 Å²	56	80.6 Å²	80.6	29%	0.287	45%	0.45	S	S	.	.			trans	-80.1	102.9	175.7	-56.4	-178.5	0	0	0	108.7	T440 N442 D444 S448	T440-I446 VanDerWaalsContact CB-CD1 3.45Å; T440-I446 HydrophobicContact CG2-CD1 4.25Å; N442-I446 HydrophobicContact CB-CD1 4.13Å; D444-I446 VanDerWaalsContact C-N 3.34Å; D444-I446 WeakPolarHBondContact O-CG1 3.36Å; D444-I446 PolarHBondContact O-N 2.73Å; I446-S448 PolarHBondContact O-N 3.11Å
447	V	48.3	Very low	50.6	Low	88 Å²	88	80.7 Å²	80.7	53%	0.533	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	101.1	165.4	174.7	0	0	0	0	107.1	R445 P454 W455	R445-V447 PolarHBondContact O-N 2.81Å; R445-V447 VanDerWaalsContact O-N 3.08Å; V447-P454 HydrophobicContact CG1-CB 3.35Å; V447-P454 HydrophobicContact CG1-CG 3.99Å; V447-W455 CarbonylContact C-O 3.43Å; V447-W455 WeakPolarHBondContact CA-O 3.33Å
448	S	53.2	Low	51	Low	19 Å²	19	77 Å²	77	13%	0.133	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	142	165.6	-153.1	0	0	0	0	108.8	K424 I446 P454 W455	K424-S448 WeakPolarHBondContact CD-OG 3.35Å; K424-S448 VanDerWaalsContact CE-OG 3.25Å; K424-S448 WeakPolarHBondContact CE-OG 3.44Å; K424-S448 PolarHBondContact NZ-OG 3.33Å; I446-S448 PolarHBondContact O-N 3.11Å; S448-P454 CarbonylContact O-C 3.58Å; S448-W455 PolarHBondContact N-O 3.34Å; S448-W455 WeakPolarHBondContact O-CA 3.33Å; S448-W455 WeakPolarHBondContact O-CB 3.26Å; S448-W455 PolarHBondContact O-N 3.04Å
449	E	57.5	Low	51.2	Low	129 Å²	129	75.5 Å²	75.5	60%	0.603	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.7	172	-71.6	179.1	-179.8	0	0	110.4	K424 V453	K424-E449 PolarHBondContact NZ-O 2.97Å; E449-V453 WeakPolarHBondContact CA-O 3.04Å
450	V	59.9	Low	51.6	Low	25 Å²	25	80.2 Å²	80.2	15%	0.152	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	110.8	165.2	179.7	0	0	0	0	106.3	L393 G452 V453 W455	L393-V450 HydrophobicContact CD1-CG1 4.23Å; L393-V450 HydrophobicContact CD2-CG1 4.33Å; V450-G452 PolarHBondContact O-N 2.93Å; V450-V453 PolarHBondContact N-O 2.82Å; V450-V453 WeakPolarHBondContact O-CB 3.07Å; V450-V453 PolarHBondContact O-N 3.24Å; V450-W455 HydrophobicContact CG2-CB 4.07Å; V450-W455 HydrophobicContact CG2-CD2 4.18Å; V450-W455 HydrophobicContact CG2-CE3 3.49Å; V450-W455 VanDerWaalsContact CG2-CE3 3.49Å; V450-W455 HydrophobicContact CG2-CG 4.45Å; V450-W455 HydrophobicContact CG2-CZ3 4.25Å
451	L	59.4	Low	51.9	Low	77 Å²	77	79.2 Å²	79.2	40%	0.403	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	41.6	177.5	-64.5	170.4	0	0	0	113.1	W234 A391 V453	W234-L451 HydrophobicContact CD2-CD1 4.2Å; W234-L451 HydrophobicContact CE3-CD1 4.34Å; W234-L451 HydrophobicContact CH2-CD1 3.4Å; W234-L451 HydrophobicContact CZ2-CB 3.93Å; W234-L451 HydrophobicContact CZ2-CD1 3.24Å; W234-L451 HydrophobicContact CZ2-CG 4.17Å; W234-L451 HydrophobicContact CZ3-CD1 3.97Å; A391-L451 HydrophobicContact CB-CD1 4.42Å; A391-L451 HydrophobicContact CB-CD2 3.62Å; A391-L451 HydrophobicContact CB-CG 4.3Å; L451-V453 VanDerWaalsContact C-N 3.26Å; L451-V453 PolarHBondContact O-N 3.44Å
452	G	62.7	Low	51.8	Low	55 Å²	55	76.8 Å²	76.8	57%	0.567	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-1.4	-178.3	0	0	0	0	0	115.1	V450	V450-G452 PolarHBondContact O-N 2.93Å
453	V	61.3	Low	51.3	Low	28 Å²	28	75.9 Å²	75.9	17%	0.17	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.2	177.6	-175.3	0	0	0	0	110.6	E449 V450 L451 W455 L464	E449-V453 WeakPolarHBondContact CA-O 3.04Å; V450-V453 PolarHBondContact N-O 2.82Å; V450-V453 WeakPolarHBondContact O-CB 3.07Å; V450-V453 PolarHBondContact O-N 3.24Å; L451-V453 VanDerWaalsContact C-N 3.26Å; L451-V453 PolarHBondContact O-N 3.44Å; V453-W455 PolarHBondContact O-N 3.44Å; V453-L464 HydrophobicContact CG1-CD2 4.04Å
454	P	63.4	Low	50.6	Low	45 Å²	45	72.9 Å²	72.9	29%	0.292	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	122	166.1	-36.1	42.3	0	0	0	113.8	V447 S448	V447-P454 HydrophobicContact CG1-CB 3.35Å; V447-P454 HydrophobicContact CG1-CG 3.99Å; S448-P454 CarbonylContact O-C 3.58Å
455	W	62.7	Low	49.8	Very low	29 Å²	29	70 Å²	70	11%	0.11	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	117.8	174.4	-177	26	0	0	0	110.4	K424 N426 V447 S448 V450 V453 L457	K424-W455 HydrophobicContact CB-CZ3 4.03Å; N426-W455 HydrophobicContact CB-CH2 4.39Å; N426-W455 HydrophobicContact CB-CZ2 3.9Å; V447-W455 CarbonylContact C-O 3.43Å; V447-W455 WeakPolarHBondContact CA-O 3.33Å; S448-W455 PolarHBondContact N-O 3.34Å; S448-W455 WeakPolarHBondContact O-CA 3.33Å; S448-W455 WeakPolarHBondContact O-CB 3.26Å; S448-W455 PolarHBondContact O-N 3.04Å; V450-W455 HydrophobicContact CG2-CB 4.07Å; V450-W455 HydrophobicContact CG2-CD2 4.18Å; V450-W455 HydrophobicContact CG2-CE3 3.49Å; V450-W455 VanDerWaalsContact CG2-CE3 3.49Å; V450-W455 HydrophobicContact CG2-CG 4.45Å; V450-W455 HydrophobicContact CG2-CZ3 4.25Å; V453-W455 PolarHBondContact O-N 3.44Å; W455-L457 HydrophobicContact CD2-CD2 3.69Å; W455-L457 HydrophobicContact CE3-CD2 3.43Å; W455-L457 VanDerWaalsContact CE3-CD2 3.43Å; W455-L457 HydrophobicContact CE3-CG 4.45Å; W455-L457 HydrophobicContact CH2-CD2 3.55Å; W455-L457 HydrophobicContact CZ2-CD2 3.75Å; W455-L457 HydrophobicContact CZ3-CD2 3.37Å; W455-L457 PolarHBondContact O-N 3.21Å
456	N	64.1	Low	48.8	Very low	35 Å²	35	70 Å²	70	19%	0.187	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	106	173	-176.2	-0.8	0	0	0	110.3	G458 Q459	N456-G458 VanDerWaalsContact C-N 3.26Å; N456-G458 PolarHBondContact O-N 3.4Å; N456-G458 PolarHBondContact OD1-N 2.75Å; N456-G458 VanDerWaalsContact OD1-N 3.16Å; N456-Q459 PolarHBondContact O-N 2.82Å
457	L	58.5	Low	47.3	Very low	30 Å²	30	75.8 Å²	75.8	16%	0.157	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-22.5	-178	-67.3	171.2	0	0	0	113.9	W455 Q459	W455-L457 HydrophobicContact CD2-CD2 3.69Å; W455-L457 HydrophobicContact CE3-CD2 3.43Å; W455-L457 VanDerWaalsContact CE3-CD2 3.43Å; W455-L457 HydrophobicContact CE3-CG 4.45Å; W455-L457 HydrophobicContact CH2-CD2 3.55Å; W455-L457 HydrophobicContact CZ2-CD2 3.75Å; W455-L457 HydrophobicContact CZ3-CD2 3.37Å; W455-L457 PolarHBondContact O-N 3.21Å; L457-Q459 VanDerWaalsContact C-N 3.27Å; L457-Q459 PolarHBondContact O-N 3Å
458	G	52.5	Low	45.9	Very low	57 Å²	57	76.9 Å²	76.9	59%	0.588	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.2	-179	0	0	0	0	0	114.2	N456	N456-G458 VanDerWaalsContact C-N 3.26Å; N456-G458 PolarHBondContact O-N 3.4Å; N456-G458 PolarHBondContact OD1-N 2.75Å; N456-G458 VanDerWaalsContact OD1-N 3.16Å
459	Q	47.5	Very low	44.6	Very low	89 Å²	89	86 Å²	86	42%	0.416	47%	0.468	S	S	.	.	S	Bend	trans	-108.4	140.1	171.3	-69	-178.6	-25	0	0	107.6	N456 L457 H461 H463	N456-Q459 PolarHBondContact O-N 2.82Å; L457-Q459 VanDerWaalsContact C-N 3.27Å; L457-Q459 PolarHBondContact O-N 3Å; Q459-H461 PolarHBondContact O-N 3.11Å; Q459-H463 PolarHBondContact OE1-CD2 3.38Å; Q459-H463 PolarHBondContact OE1-NE2 2.95Å
460	E	49.4	Very low	44	Very low	139 Å²	139	83.9 Å²	83.9	65%	0.65	46%	0.461	S	S	*	.	S	Bend	trans	-52.1	-10.6	171.4	-71.6	179	167.7	0	0	113.1	K106	K106-E460 IonicContact NZ-OE2 2.7Å; K106-E460 PolarHBondContact NZ-OE2 3.07Å
461	H	46.2	Very low	43.1	Very low	48 Å²	48	87 Å²	87	22%	0.222	48%	0.478	C	S	.	.	S	Bend	trans	-120.5	134.8	-165.5	-63.4	-75	0	0	0	111.8	K106 Q459 H463	K106-H461 PolarHBondContact NZ-NE2 3.03Å; Q459-H461 PolarHBondContact O-N 3.11Å; H461-H463 PolarHBondContact O-N 3.16Å
462	C	32.7	Very low	42.2	Very low	29 Å²	29	87.6 Å²	87.6	20%	0.196	48%	0.482	C	S	.	.			trans	-73.3	106.5	161.2	-167.5	0	0	0	0	109.1	L464	C462-L464 PolarHBondContact O-N 3.32Å
463	H	25.2	Very low	41	Very low	109 Å²	109	89.5 Å²	89.5	51%	0.505	48%	0.477	S	S	.	.			trans	-84.5	98.4	173.7	-82.6	-82.9	0	0	0	110.3	Q459 H461 S465	Q459-H463 PolarHBondContact OE1-CD2 3.38Å; Q459-H463 PolarHBondContact OE1-NE2 2.95Å; H461-H463 PolarHBondContact O-N 3.16Å; H463-S465 PolarHBondContact O-N 3.45Å; H463-S465 VanDerWaalsContact O-N 3.13Å
464	L	24.3	Very low	39.8	Very low	93 Å²	93	93.3 Å²	93.3	49%	0.487	50%	0.496	S	S	.	.			trans	-61.2	107.5	166.3	-81.1	148	0	0	0	110	L230 V453 C462	L230-L464 HydrophobicContact CD2-CD2 3.98Å; V453-L464 HydrophobicContact CG1-CD2 4.04Å; C462-L464 PolarHBondContact O-N 3.32Å
465	S	22.3	Very low	38.2	Very low	72 Å²	72	96.5 Å²	96.5	50%	0.503	51%	0.51	S	S	.	.			trans	-114.5	105.4	162.1	72.2	0	0	0	0	109.6	H463 H467	H463-S465 PolarHBondContact O-N 3.45Å; H463-S465 VanDerWaalsContact O-N 3.13Å; S465-H467 PolarHBondContact O-N 3.34Å
466	R	22.5	Very low	36.4	Very low	217 Å²	217	101.4 Å²	101.4	82%	0.819	54%	0.538	S	S	*	.			trans	-74.8	119.7	174.4	-168.5	-179.2	-175.4	-173.6	2.1	108.7
467	H	20.4	Very low	34.3	Very low	178 Å²	178	106.5 Å²	106.5	82%	0.824	57%	0.565	S	S	*	*			trans	-102.4	108.5	157.8	-77.8	-24.6	0	0	0	108.2	S465 T469	S465-H467 PolarHBondContact O-N 3.34Å; H467-T469 PolarHBondContact O-N 3.41Å
468	T	19.2	Very low	32.3	Very low	111 Å²	111	112.8 Å²	112.8	68%	0.681	60%	0.599	S	S	*	*			trans	-69.4	113.6	162.8	41.3	0	0	0	0	107.8
469	T	25.2	Very low	30.4	Very low	212 Å²	212	117.9 Å²	117.9	100%	1.301	60%	0.6	S	S	*	*			trans	-88	0	146.2	39.8	0	0	0	0	109.4	H467	H467-T469 PolarHBondContact O-N 3.41Å

Retrieved 469 of 469 residues in 439.7 ms (Link to these results)

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