A0A3Q0KEL6_SCHMA Loading...

Family S12 unassigned peptidase (S12 family)

AlphaFold DB , UniProt , Accession A0A3Q0KEL6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 510 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	33.2	Very low	31.2	Very low	237 Å²	237	157.9 Å²	157.9	100%	1.167	85%	0.853	S	S	*	*				0	77.5	0	-76.9	160.3	71.9	0	0	107.8
2	K	31.2	Very low	31	Very low	214 Å²	214	157.8 Å²	157.8	93%	0.93	85%	0.85	S	S	*	*				55.1	83.4	102.2	-79.5	-169.2	178.5	179.4	0	114.9
3	I	35.1	Very low	30.6	Very low	176 Å²	176	152 Å²	152	90%	0.903	84%	0.837	S	S	*	*			trans	-87.8	134.7	152.8	-65.4	172.9	0	0	0	107
4	R	31.5	Very low	30.3	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	83%	0.832	S	S	*	*			trans	-104.9	122.3	-160.2	-141.7	176.5	173.2	175.6	-5.4	110.1
5	N	33.8	Very low	30.2	Very low	146 Å²	146	151.5 Å²	151.5	78%	0.781	84%	0.835	S	S	*	*			trans	30.8	124.5	144.9	-59.8	-5.6	0	0	0	121.5
6	G	33	Very low	30.3	Very low	78 Å²	78	151.1 Å²	151.1	80%	0.804	83%	0.829	S	S	*	*			trans	-150.4	89.2	149.8	0	0	0	0	0	109.1
7	L	28.6	Very low	30	Very low	150 Å²	150	149.5 Å²	149.5	79%	0.785	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-74	126.6	-178.3	-126.5	89.9	0	0	0	110.1
8	V	31.1	Very low	30	Very low	142 Å²	142	147.1 Å²	147.1	86%	0.861	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-96.2	120.3	163.9	174.7	0	0	0	0	107.8
9	L	27.6	Very low	30	Very low	146 Å²	146	142.9 Å²	142.9	76%	0.764	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-63.7	126	-173.8	-108.2	81.8	0	0	0	112.9
10	T	26.7	Very low	30	Very low	136 Å²	136	145.9 Å²	145.9	83%	0.834	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.5	132.2	145.9	41.9	0	0	0	0	110
11	A	31	Very low	30	Very low	84 Å²	84	146.2 Å²	146.2	69%	0.694	82%	0.818	S	S	*	*			trans	-152.6	143.2	166.7	0	0	0	0	0	108.6
12	L	28.7	Very low	29.8	Very low	156 Å²	156	142.2 Å²	142.2	82%	0.817	80%	0.796	S	S	*	*			cis	-167.6	132.3	-26	-133.9	136.4	0	0	0	103.7
13	A	26.4	Very low	29.5	Very low	83 Å²	83	137.3 Å²	137.3	69%	0.686	79%	0.788	S	S	*	*			trans	-79.4	152.2	166.3	0	0	0	0	0	109.8
14	S	26.3	Very low	29.2	Very low	109 Å²	109	134 Å²	134	76%	0.762	78%	0.781	S	S	*	*			trans	78.1	116.6	162.8	78.7	0	0	0	0	118.9
15	Q	29.5	Very low	28.9	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	78%	0.78	S	S	*	*			trans	168.3	122	151.7	-96.6	175.4	22.9	0	0	102.5
16	I	31.6	Very low	28.6	Very low	144 Å²	144	134.8 Å²	134.8	74%	0.738	78%	0.784	S	S	*	*			cis	-159.4	125.8	44.1	-65.3	-178.4	0	0	0	107.7
17	S	25.5	Very low	28.5	Very low	125 Å²	125	140.5 Å²	140.5	87%	0.874	79%	0.789	S	S	*	*			trans	-97.3	120.2	156	167.6	0	0	0	0	106.9
18	S	28.7	Very low	28.4	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	79%	0.793	S	S	*	*			trans	174.1	123.4	149.8	54.7	0	0	0	0	110.2
19	G	30.7	Very low	28.6	Very low	67 Å²	67	143.5 Å²	143.5	69%	0.691	79%	0.79	S	S	*	*			trans	154.6	92.2	160.2	0	0	0	0	0	116.4
20	F	29.8	Very low	28.9	Very low	203 Å²	203	145.7 Å²	145.7	89%	0.89	79%	0.788	S	S	*	*			trans	57.8	106.7	143.7	-76.6	-95.4	0	0	0	120
21	H	30.8	Very low	29.2	Very low	153 Å²	153	148.5 Å²	148.5	71%	0.708	79%	0.792	S	S	*	*				81.2	120.4	83.7	-126.6	53.2	0	0	0	115.6
22	E	28	Very low	29.8	Very low	153 Å²	153	148.6 Å²	148.6	72%	0.715	78%	0.778	S	S	*	*			trans	67.9	106.6	147.3	-76	-178.5	147.8	0	0	123.1
23	S	24.9	Very low	29.9	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	78%	0.782	S	S	*	*				82.7	143.5	124	87.1	0	0	0	0	120.3
24	S	28.1	Very low	30.7	Very low	107 Å²	107	148 Å²	148	75%	0.748	76%	0.756	S	S	*	*			trans	98.4	99.6	162	83.4	0	0	0	0	118.9
25	K	26.7	Very low	31.3	Very low	194 Å²	194	150.3 Å²	150.3	84%	0.843	75%	0.754	S	S	*	*				51.1	125.5	116.7	-68.8	178.6	178.6	174.9	0	119.4
26	K	27.9	Very low	31.7	Very low	197 Å²	197	152.8 Å²	152.8	86%	0.857	76%	0.756	S	S	*	*	S	Bend	trans	80.5	134.3	150.7	-67.7	179.8	174.8	-176	0	117.2	R28	K26-R28 PolarHBondContact O-N 3.41Å
27	H	30.3	Very low	32.2	Very low	197 Å²	197	153.9 Å²	153.9	91%	0.912	76%	0.757	S	S	*	*			trans	-21.5	113.6	176.7	-74.9	-1.6	0	0	0	114.7
28	R	26.7	Very low	33.6	Very low	232 Å²	232	150.9 Å²	150.9	88%	0.875	73%	0.732	S	S	*	*			trans	-109.2	129	158.4	-83.4	-172.7	175.5	-171.3	-0.1	108.8	K26	K26-R28 PolarHBondContact O-N 3.41Å
29	P	33.7	Very low	35.2	Very low	123 Å²	123	148.1 Å²	148.1	80%	0.799	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-65.6	135	164.4	6.2	7.3	0	0	0	108.3	Q31	P29-Q31 PolarHBondContact O-N 3.38Å
30	R	35.7	Very low	37.1	Very low	192 Å²	192	148.6 Å²	148.6	73%	0.725	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-68.9	127.3	179	-71.3	179	173.4	-179.2	-2.5	109.4	H32 E94	R30-H32 PolarHBondContact O-N 3.28Å; R30-E94 IonicContact CZ-OE1 3.9Å; R30-E94 IonicContact NH1-OE1 3.03Å; R30-E94 PolarHBondContact NH1-OE1 3.49Å; R30-E94 IonicContact NH1-OE2 3.68Å; R30-E94 PolarHBondContact NH1-OE2 3Å; R30-E94 VanDerWaalsContact NH1-OE2 3.14Å; R30-E94 IonicContact NH2-OE1 3.96Å
31	Q	31.5	Very low	39.5	Very low	196 Å²	196	144.9 Å²	144.9	92%	0.916	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-71.6	123.3	179.3	-76.7	-179.8	-19.2	0	0	110.9	P29	P29-Q31 PolarHBondContact O-N 3.38Å
32	H	44.2	Very low	42.3	Very low	85 Å²	85	137.7 Å²	137.7	39%	0.394	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-79.1	132.8	161.9	-64.4	-36.4	0	0	0	109.5	R30 Y34	R30-H32 PolarHBondContact O-N 3.28Å; H32-Y34 HydrophobicContact CB-CD2 3.66Å; H32-Y34 HydrophobicContact CB-CE2 3.36Å; H32-Y34 PolarHBondContact O-N 3Å
33	Q	30.9	Very low	45.3	Very low	191 Å²	191	133.7 Å²	133.7	89%	0.893	64%	0.639	S	S	*	*			trans	-76.8	104.4	172.5	-91.8	179.6	-28.4	0	0	109.8
34	Y	42.3	Very low	48.6	Very low	36 Å²	36	132.4 Å²	132.4	14%	0.141	62%	0.623	C	S	.	*			trans	-122.5	151.6	165.5	-69.4	-81.5	0	0	0	109.3	H32 I42 I76	H32-Y34 HydrophobicContact CB-CD2 3.66Å; H32-Y34 HydrophobicContact CB-CE2 3.36Å; H32-Y34 PolarHBondContact O-N 3Å; Y34-I42 HydrophobicContact CD1-CD1 4.34Å; Y34-I42 HydrophobicContact CD2-CG2 4.04Å; Y34-I42 HydrophobicContact CE1-CD1 3.63Å; Y34-I42 HydrophobicContact CE2-CD1 3.84Å; Y34-I42 HydrophobicContact CE2-CG2 4.24Å; Y34-I42 HydrophobicContact CG-CG2 4.26Å; Y34-I42 WeakPolarHBondContact OH-CD1 3.41Å; Y34-I76 WeakPolarHBondContact OH-CA 3.4Å
35	H	39.1	Very low	51.8	Low	157 Å²	157	127.6 Å²	127.6	73%	0.727	59%	0.589	S	S	*	*			trans	-55.5	146.6	170.6	-93.5	-77	0	0	0	109.5	Q37 D38 S39	H35-Q37 PolarHBondContact O-N 2.87Å; H35-D38 WeakPolarHBondContact O-CB 3.12Å; H35-D38 PolarHBondContact O-N 3.38Å; H35-D38 VanDerWaalsContact O-N 3.1Å; H35-S39 WeakPolarHBondContact O-CB 3.32Å; H35-S39 PolarHBondContact O-N 2.82Å
36	R	39.5	Very low	55.1	Low	241 Å²	241	119.5 Å²	119.5	91%	0.909	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-27	-168.7	-95.8	-175.4	-179.8	-178.6	0.5	114.8
37	Q	40.7	Very low	58.3	Low	166 Å²	166	113 Å²	113	78%	0.776	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-41.9	174.9	-87.3	170.6	-41.2	0	0	112.6	H35 S39 S40	H35-Q37 PolarHBondContact O-N 2.87Å; Q37-S39 PolarHBondContact O-N 3.19Å; Q37-S39 VanDerWaalsContact O-N 3.16Å; Q37-S40 PolarHBondContact O-N 3.26Å; Q37-S40 PolarHBondContact O-OG 2.76Å
38	D	55.8	Low	61.5	Low	63 Å²	63	108.3 Å²	108.3	34%	0.337	51%	0.508	S	S	.	.	H	α-helix	trans	-55.3	-33	169.6	-61.7	-14.9	0	0	0	112.3	H35 S40 Y41 I42	H35-D38 WeakPolarHBondContact O-CB 3.12Å; H35-D38 PolarHBondContact O-N 3.38Å; H35-D38 VanDerWaalsContact O-N 3.1Å; D38-S40 VanDerWaalsContact C-N 3.35Å; D38-S40 PolarHBondContact O-N 2.75Å; D38-Y41 PolarHBondContact O-N 3.3Å; D38-I42 WeakPolarHBondContact O-CG2 3.08Å; D38-I42 PolarHBondContact O-N 2.79Å
39	S	61.7	Low	64.9	Low	47 Å²	47	97.2 Å²	97.2	33%	0.329	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-33.5	-172.1	-171.8	0	0	0	0	113.4	H35 Q37 T43	H35-S39 WeakPolarHBondContact O-CB 3.32Å; H35-S39 PolarHBondContact O-N 2.82Å; Q37-S39 PolarHBondContact O-N 3.19Å; Q37-S39 VanDerWaalsContact O-N 3.16Å; S39-T43 WeakPolarHBondContact O-CB 3.33Å; S39-T43 PolarHBondContact O-OG1 3.14Å
40	S	69.8	Low	68	Low	78 Å²	78	94.7 Å²	94.7	55%	0.545	44%	0.444	S	S	.	.	H	α-helix	trans	-77.7	-40.5	179.8	57.1	0	0	0	0	112.1	Q37 D38 T43	Q37-S40 PolarHBondContact O-N 3.26Å; Q37-S40 PolarHBondContact O-OG 2.76Å; D38-S40 VanDerWaalsContact C-N 3.35Å; D38-S40 PolarHBondContact O-N 2.75Å; S40-T43 WeakPolarHBondContact O-CB 3.48Å; S40-T43 PolarHBondContact O-N 2.75Å
41	Y	81.6	Confident	70.9	Confident	125 Å²	125	92.9 Å²	92.9	49%	0.49	44%	0.441	S	S	.	.	H	α-helix	trans	-68.4	-50	-176.3	-74.1	-78.9	0	0	0	111.8	D38 T43 D44 Y45 L507	D38-Y41 PolarHBondContact O-N 3.3Å; Y41-T43 PolarHBondContact O-N 3.21Å; Y41-D44 PolarHBondContact O-N 3.23Å; Y41-Y45 WeakPolarHBondContact O-CD2 3.5Å; Y41-L507 HydrophobicContact CE2-CD1 4.4Å
42	I	89.1	Confident	74.1	Confident	1 Å²	1	86 Å²	86	1%	0.005	41%	0.41	C	S	.	.	H	α-helix	trans	-63.8	-26	178.8	-159.6	177.3	0	0	0	112.1	Y34 D38 D44 Y45 I46 I76 Y500	Y34-I42 HydrophobicContact CD1-CD1 4.34Å; Y34-I42 HydrophobicContact CD2-CG2 4.04Å; Y34-I42 HydrophobicContact CE1-CD1 3.63Å; Y34-I42 HydrophobicContact CE2-CD1 3.84Å; Y34-I42 HydrophobicContact CE2-CG2 4.24Å; Y34-I42 HydrophobicContact CG-CG2 4.26Å; Y34-I42 WeakPolarHBondContact OH-CD1 3.41Å; D38-I42 WeakPolarHBondContact O-CG2 3.08Å; D38-I42 PolarHBondContact O-N 2.79Å; I42-D44 VanDerWaalsContact C-N 3.32Å; I42-D44 PolarHBondContact O-N 2.9Å; I42-Y45 PolarHBondContact O-N 2.93Å; I42-I46 HydrophobicContact CD1-CD1 4.32Å; I42-I46 HydrophobicContact CG1-CD1 4.01Å; I42-I46 HydrophobicContact CG1-CG1 4.22Å; I42-I46 HydrophobicContact CG2-CD1 4.23Å; I42-I46 WeakPolarHBondContact O-CB 3.27Å; I42-I46 VanDerWaalsContact O-CG1 3.32Å; I42-I46 WeakPolarHBondContact O-CG1 3.23Å; I42-I46 PolarHBondContact O-N 2.74Å; I42-I76 HydrophobicContact CD1-CB 4.28Å; I42-Y500 HydrophobicContact CB-CE2 3.8Å; I42-Y500 HydrophobicContact CD1-CE1 3.91Å; I42-Y500 HydrophobicContact CG1-CE1 3.97Å; I42-Y500 HydrophobicContact CG1-CE2 3.96Å
43	T	91.1	Very high	76.7	Confident	69 Å²	69	82 Å²	82	42%	0.423	39%	0.391	S	S	.	.	H	α-helix	trans	-62.7	-35.7	179	-66.9	0	0	0	0	112.6	S39 S40 Y41 S47	S39-T43 WeakPolarHBondContact O-CB 3.33Å; S39-T43 PolarHBondContact O-OG1 3.14Å; S40-T43 WeakPolarHBondContact O-CB 3.48Å; S40-T43 PolarHBondContact O-N 2.75Å; Y41-T43 PolarHBondContact O-N 3.21Å; T43-S47 WeakPolarHBondContact O-CB 3.37Å; T43-S47 PolarHBondContact O-N 2.84Å; T43-S47 PolarHBondContact O-OG 2.88Å
44	D	93.5	Very high	79.8	Confident	83 Å²	83	78 Å²	78	44%	0.444	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-48	173.7	177.8	66.3	0	0	0	111.1	Y41 I42 I46 S47 R48	Y41-D44 PolarHBondContact O-N 3.23Å; I42-D44 VanDerWaalsContact C-N 3.32Å; I42-D44 PolarHBondContact O-N 2.9Å; D44-I46 PolarHBondContact O-N 3.38Å; D44-S47 WeakPolarHBondContact O-CB 3.3Å; D44-S47 PolarHBondContact O-N 3Å; D44-S47 VanDerWaalsContact O-N 3.15Å; D44-R48 WeakPolarHBondContact O-CG 3.47Å; D44-R48 PolarHBondContact O-N 2.87Å; D44-R48 VanDerWaalsContact OD2-CD 3.28Å; D44-R48 WeakPolarHBondContact OD2-CD 3.45Å; D44-R48 IonicContact OD2-NH1 3.65Å
45	Y	95.4	Very high	82.5	Confident	6 Å²	6	80.3 Å²	80.3	2%	0.024	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-42.6	178.3	-74.6	-84.7	0	0	0	112.4	Y41 I42 R48 A49 L496 D499 Y500 K503	Y41-Y45 WeakPolarHBondContact O-CD2 3.5Å; I42-Y45 PolarHBondContact O-N 2.93Å; Y45-R48 PolarHBondContact O-N 3.47Å; Y45-A49 WeakPolarHBondContact O-CB 3.25Å; Y45-A49 PolarHBondContact O-N 2.79Å; Y45-L496 HydrophobicContact CD1-CD1 3.59Å; Y45-L496 HydrophobicContact CD1-CG 3.97Å; Y45-L496 VanDerWaalsContact CD1-O 3.24Å; Y45-L496 WeakPolarHBondContact CD1-O 3.15Å; Y45-L496 HydrophobicContact CE1-CD1 4.05Å; Y45-L496 VanDerWaalsContact CE1-O 3.27Å; Y45-L496 WeakPolarHBondContact CE1-O 3.42Å; Y45-D499 HydrophobicContact CE1-CB 4.09Å; Y45-D499 WeakPolarHBondContact CE1-OD2 3.35Å; Y45-D499 VanDerWaalsContact OH-CG 3.26Å; Y45-D499 PolarHBondContact OH-OD2 3.37Å; Y45-Y500 AromaticContact CD2-CD2 3.56Å; Y45-Y500 HydrophobicContact CD2-CD2 3.56Å; Y45-Y500 HydrophobicContact CD2-CG 4.09Å; Y45-Y500 AromaticContact CE2-CD2 3.86Å; Y45-Y500 HydrophobicContact CE2-CD2 3.86Å; Y45-Y500 HydrophobicContact CE2-CG 4.43Å; Y45-Y500 HydrophobicContact CG-CD2 4.08Å; Y45-Y500 HydrophobicContact CG-CG 4.17Å; Y45-K503 WeakPolarHBondContact OH-CD 3.47Å; Y45-K503 WeakPolarHBondContact OH-CE 3.41Å; Y45-K503 PolarHBondContact OH-NZ 2.78Å
46	I	96.3	Very high	85.3	Confident	24 Å²	24	74 Å²	74	12%	0.123	36%	0.357	C	S	.	.	H	α-helix	trans	-59.8	-47.7	173.1	-70.8	166	0	0	0	110	I42 D44 R48 A49 Q50 Y77	I42-I46 HydrophobicContact CD1-CD1 4.32Å; I42-I46 HydrophobicContact CG1-CD1 4.01Å; I42-I46 HydrophobicContact CG1-CG1 4.22Å; I42-I46 HydrophobicContact CG2-CD1 4.23Å; I42-I46 WeakPolarHBondContact O-CB 3.27Å; I42-I46 VanDerWaalsContact O-CG1 3.32Å; I42-I46 WeakPolarHBondContact O-CG1 3.23Å; I42-I46 PolarHBondContact O-N 2.74Å; D44-I46 PolarHBondContact O-N 3.38Å; I46-R48 VanDerWaalsContact C-N 3.3Å; I46-R48 PolarHBondContact O-N 2.79Å; I46-A49 WeakPolarHBondContact O-CB 3.48Å; I46-A49 PolarHBondContact O-N 3.32Å; I46-A49 VanDerWaalsContact O-N 3.14Å; I46-Q50 HydrophobicContact CG2-CG 4.3Å; I46-Q50 VanDerWaalsContact O-CG 3.29Å; I46-Q50 WeakPolarHBondContact O-CG 3.29Å; I46-Q50 PolarHBondContact O-N 3.2Å; I46-Y77 HydrophobicContact CG2-CD2 4.26Å
47	S	96.2	Very high	88	Confident	60 Å²	60	63.9 Å²	63.9	42%	0.42	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-39	-179.7	-60.7	0	0	0	0	112.4	T43 D44 K51	T43-S47 WeakPolarHBondContact O-CB 3.37Å; T43-S47 PolarHBondContact O-N 2.84Å; T43-S47 PolarHBondContact O-OG 2.88Å; D44-S47 WeakPolarHBondContact O-CB 3.3Å; D44-S47 PolarHBondContact O-N 3Å; D44-S47 VanDerWaalsContact O-N 3.15Å; S47-K51 PolarHBondContact O-N 3.11Å
48	R	97.1	Very high	90.6	Very high	99 Å²	99	62 Å²	62	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-65.7	-44.1	174.1	-70.7	167.3	63.8	-167.8	-2.8	111.5	D44 Y45 I46 K51 M52 L496 D499	D44-R48 WeakPolarHBondContact O-CG 3.47Å; D44-R48 PolarHBondContact O-N 2.87Å; D44-R48 VanDerWaalsContact OD2-CD 3.28Å; D44-R48 WeakPolarHBondContact OD2-CD 3.45Å; D44-R48 IonicContact OD2-NH1 3.65Å; Y45-R48 PolarHBondContact O-N 3.47Å; I46-R48 VanDerWaalsContact C-N 3.3Å; I46-R48 PolarHBondContact O-N 2.79Å; R48-K51 PolarHBondContact O-N 3.36Å; R48-M52 WeakPolarHBondContact O-CG 3.29Å; R48-M52 PolarHBondContact O-N 2.98Å; R48-L496 HydrophobicContact CB-CD1 4.01Å; R48-L496 HydrophobicContact CB-CD2 3.99Å; R48-D499 IonicContact NH1-OD2 3.71Å
49	A	98.1	Very high	92.5	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.2	-47.7	176.4	0	0	0	0	0	111.2	Y45 I46 K51 M52 V53 Y77 L493 L496 F497	Y45-A49 WeakPolarHBondContact O-CB 3.25Å; Y45-A49 PolarHBondContact O-N 2.79Å; I46-A49 WeakPolarHBondContact O-CB 3.48Å; I46-A49 PolarHBondContact O-N 3.32Å; I46-A49 VanDerWaalsContact O-N 3.14Å; A49-K51 PolarHBondContact O-N 3.38Å; A49-M52 WeakPolarHBondContact O-CB 3.18Å; A49-M52 PolarHBondContact O-N 2.66Å; A49-M52 VanDerWaalsContact O-N 3.16Å; A49-V53 WeakPolarHBondContact O-CG2 3.05Å; A49-V53 PolarHBondContact O-N 3.01Å; A49-Y77 HydrophobicContact CB-CD1 4.27Å; A49-Y77 HydrophobicContact CB-CD2 4.19Å; A49-Y77 HydrophobicContact CB-CE1 4.08Å; A49-Y77 HydrophobicContact CB-CE2 4.03Å; A49-Y77 HydrophobicContact CB-CG 4.3Å; A49-L493 HydrophobicContact CB-CD2 3.8Å; A49-L496 HydrophobicContact CB-CD2 3.7Å; A49-F497 HydrophobicContact CB-CE2 3.97Å; A49-F497 HydrophobicContact CB-CZ 3.85Å
50	Q	97.6	Very high	94.1	Very high	69 Å²	69	67 Å²	67	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-55.5	-50.9	174.9	-68.9	-175.7	-60	0	0	110.6	I46 M52 V53 Y54 Y77 E79	I46-Q50 HydrophobicContact CG2-CG 4.3Å; I46-Q50 VanDerWaalsContact O-CG 3.29Å; I46-Q50 WeakPolarHBondContact O-CG 3.29Å; I46-Q50 PolarHBondContact O-N 3.2Å; Q50-M52 VanDerWaalsContact C-N 3.27Å; Q50-M52 PolarHBondContact O-N 3.29Å; Q50-V53 PolarHBondContact O-N 2.99Å; Q50-V53 VanDerWaalsContact O-N 3.1Å; Q50-Y54 HydrophobicContact CB-CD2 4.36Å; Q50-Y54 HydrophobicContact CB-CE2 4.44Å; Q50-Y54 VanDerWaalsContact O-CD2 3.23Å; Q50-Y54 WeakPolarHBondContact O-CD2 3.31Å; Q50-Y54 PolarHBondContact O-N 3.21Å; Q50-Y77 HydrophobicContact CG-CE2 3.76Å; Q50-E79 WeakPolarHBondContact CG-OE2 3.12Å; Q50-E79 PolarHBondContact NE2-OE1 3.36Å
51	K	97.9	Very high	95.2	Very high	154 Å²	154	64.4 Å²	64.4	67%	0.67	31%	0.31	S	S	*	.	H	α-helix	trans	-55.6	-42.3	178.7	-174.4	177.6	179.3	-179.8	0	112.2	S47 R48 A49 T55	S47-K51 PolarHBondContact O-N 3.11Å; R48-K51 PolarHBondContact O-N 3.36Å; A49-K51 PolarHBondContact O-N 3.38Å; K51-T55 VanDerWaalsContact O-CB 3.22Å; K51-T55 WeakPolarHBondContact O-CB 3.45Å; K51-T55 PolarHBondContact O-N 2.95Å; K51-T55 PolarHBondContact O-OG1 2.89Å
52	M	97.9	Very high	95.9	Very high	52 Å²	52	58.5 Å²	58.5	26%	0.256	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-46.7	176.4	-67.4	165	57.3	0	0	111.8	R48 A49 Q50 T55 F56 L489 N492 L493 L496	R48-M52 WeakPolarHBondContact O-CG 3.29Å; R48-M52 PolarHBondContact O-N 2.98Å; A49-M52 WeakPolarHBondContact O-CB 3.18Å; A49-M52 PolarHBondContact O-N 2.66Å; A49-M52 VanDerWaalsContact O-N 3.16Å; Q50-M52 VanDerWaalsContact C-N 3.27Å; Q50-M52 PolarHBondContact O-N 3.29Å; M52-T55 PolarHBondContact O-N 2.94Å; M52-F56 VanDerWaalsContact O-CB 3.28Å; M52-F56 WeakPolarHBondContact O-CB 3.49Å; M52-F56 PolarHBondContact O-N 2.94Å; M52-L489 HydrophobicContact CB-CD1 4.11Å; M52-L489 HydrophobicContact CE-CD1 4.29Å; M52-N492 HydrophobicContact CE-CB 3.33Å; M52-L493 HydrophobicContact CE-CD2 4.14Å; M52-L493 HydrophobicContact CE-CG 4.25Å; M52-L496 HydrophobicContact SD-CD2 3.93Å
53	V	98.2	Very high	96.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-47.6	-179.6	164	0	0	0	0	111.9	A49 Q50 F56 K57 M65 V67 Y77 V81 L493	A49-V53 WeakPolarHBondContact O-CG2 3.05Å; A49-V53 PolarHBondContact O-N 3.01Å; Q50-V53 PolarHBondContact O-N 2.99Å; Q50-V53 VanDerWaalsContact O-N 3.1Å; V53-F56 PolarHBondContact O-N 3.29Å; V53-K57 WeakPolarHBondContact O-CB 3.24Å; V53-K57 PolarHBondContact O-N 3.06Å; V53-M65 HydrophobicContact CB-CE 4.34Å; V53-M65 HydrophobicContact CG1-CE 3.63Å; V53-M65 WeakPolarHBondContact O-CE 3.45Å; V53-V67 HydrophobicContact CG1-CG2 4.05Å; V53-V67 HydrophobicContact CG2-CB 4.39Å; V53-V67 HydrophobicContact CG2-CG1 4.31Å; V53-V67 HydrophobicContact CG2-CG2 3.89Å; V53-Y77 HydrophobicContact CG2-CE1 4.16Å; V53-Y77 VanDerWaalsContact CG2-OH 3.29Å; V53-Y77 WeakPolarHBondContact CG2-OH 3.49Å; V53-V81 HydrophobicContact CG1-CG1 3.93Å; V53-V81 HydrophobicContact CG1-CG2 3.93Å; V53-L493 HydrophobicContact CG2-CD1 4.25Å; V53-L493 HydrophobicContact CG2-CD2 4.41Å
54	Y	97.6	Very high	96.6	Very high	109 Å²	109	55.8 Å²	55.8	43%	0.427	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-45.4	176.2	-80.7	-81.6	0	0	0	111.8	Q50 F56 K57 E58 E79 V81	Q50-Y54 HydrophobicContact CB-CD2 4.36Å; Q50-Y54 HydrophobicContact CB-CE2 4.44Å; Q50-Y54 VanDerWaalsContact O-CD2 3.23Å; Q50-Y54 WeakPolarHBondContact O-CD2 3.31Å; Q50-Y54 PolarHBondContact O-N 3.21Å; Y54-F56 VanDerWaalsContact C-N 3.3Å; Y54-F56 PolarHBondContact O-N 2.84Å; Y54-K57 PolarHBondContact O-N 3.18Å; Y54-E58 WeakPolarHBondContact O-CG 3.29Å; Y54-E58 PolarHBondContact O-N 3.21Å; Y54-E79 VanDerWaalsContact CE2-OE1 3.31Å; Y54-E79 WeakPolarHBondContact CE2-OE1 3.13Å; Y54-E79 PolarHBondContact OH-OE1 2.61Å; Y54-V81 HydrophobicContact CD1-CG1 4.3Å; Y54-V81 HydrophobicContact CD2-CG1 4.42Å; Y54-V81 HydrophobicContact CE1-CB 4.3Å; Y54-V81 HydrophobicContact CE1-CG1 3.78Å; Y54-V81 HydrophobicContact CE2-CG1 3.9Å
55	T	97.7	Very high	96.9	Very high	83 Å²	83	51.9 Å²	51.9	51%	0.509	25%	0.25	S	C	.	.	H	α-helix	trans	-60.2	-43	178.5	-57.9	0	0	0	0	111	K51 M52 K59	K51-T55 VanDerWaalsContact O-CB 3.22Å; K51-T55 WeakPolarHBondContact O-CB 3.45Å; K51-T55 PolarHBondContact O-N 2.95Å; K51-T55 PolarHBondContact O-OG1 2.89Å; M52-T55 PolarHBondContact O-N 2.94Å; T55-K59 WeakPolarHBondContact O-CB 3.46Å; T55-K59 PolarHBondContact O-N 3.2Å
56	F	97.8	Very high	97	Very high	24 Å²	24	51.7 Å²	51.7	11%	0.105	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-47.1	177	-176	-92.5	0	0	0	112	M52 V53 Y54 E58 K59 M60 M65 V483 S484 G485 I486 L489	M52-F56 VanDerWaalsContact O-CB 3.28Å; M52-F56 WeakPolarHBondContact O-CB 3.49Å; M52-F56 PolarHBondContact O-N 2.94Å; V53-F56 PolarHBondContact O-N 3.29Å; Y54-F56 VanDerWaalsContact C-N 3.3Å; Y54-F56 PolarHBondContact O-N 2.84Å; F56-E58 VanDerWaalsContact C-N 3.32Å; F56-E58 PolarHBondContact O-N 3.19Å; F56-K59 PolarHBondContact O-N 3.43Å; F56-M60 HydrophobicContact CD1-CG 4.12Å; F56-M60 HydrophobicContact CD2-CG 4.08Å; F56-M60 HydrophobicContact CE1-CB 4.42Å; F56-M60 HydrophobicContact CE1-CG 3.81Å; F56-M60 HydrophobicContact CE2-CG 3.75Å; F56-M60 HydrophobicContact CE2-SD 4.5Å; F56-M60 HydrophobicContact CG-CG 4.25Å; F56-M60 HydrophobicContact CZ-CG 3.61Å; F56-M60 WeakPolarHBondContact O-CB 3.35Å; F56-M60 WeakPolarHBondContact O-CG 3.32Å; F56-M60 PolarHBondContact O-N 2.92Å; F56-M65 HydrophobicContact CD1-CE 4.04Å; F56-M65 HydrophobicContact CD1-SD 3.92Å; F56-M65 HydrophobicContact CE1-SD 4.18Å; F56-V483 HydrophobicContact CE1-CG1 3.66Å; F56-V483 HydrophobicContact CZ-CG1 3.67Å; F56-S484 WeakPolarHBondContact CZ-O 3.45Å; F56-G485 WeakPolarHBondContact CE2-O 3.43Å; F56-I486 HydrophobicContact CZ-CB 4.17Å; F56-L489 HydrophobicContact CB-CD1 4.39Å; F56-L489 HydrophobicContact CB-CD2 3.83Å; F56-L489 HydrophobicContact CD1-CD2 3.55Å; F56-L489 HydrophobicContact CD2-CB 4.1Å; F56-L489 HydrophobicContact CD2-CD2 4.12Å; F56-L489 HydrophobicContact CE1-CD2 4.09Å; F56-L489 HydrophobicContact CE2-CB 4.22Å; F56-L489 HydrophobicContact CG-CB 4.41Å; F56-L489 HydrophobicContact CG-CD2 3.56Å; F56-L489 HydrophobicContact CG-CG 4.41Å
57	K	96.8	Very high	97.1	Very high	29 Å²	29	50.5 Å²	50.5	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-54.4	-48.6	176.8	179.5	-160.8	162.2	-70.3	0	111.1	V53 Y54 G61 C62 M65 V81	V53-K57 WeakPolarHBondContact O-CB 3.24Å; V53-K57 PolarHBondContact O-N 3.06Å; Y54-K57 PolarHBondContact O-N 3.18Å; K57-G61 CarbonylContact O-C 3.56Å; K57-G61 WeakPolarHBondContact O-CA 3.38Å; K57-G61 PolarHBondContact O-N 3.29Å; K57-C62 WeakPolarHBondContact CE-O 3.13Å; K57-C62 HydrophobicContact CG-CB 4.04Å; K57-C62 VanDerWaalsContact CG-O 3.31Å; K57-C62 WeakPolarHBondContact CG-O 3.42Å; K57-C62 PolarHBondContact O-N 3.44Å; K57-M65 HydrophobicContact CB-CE 4.18Å; K57-V81 HydrophobicContact CB-CG2 4.3Å; K57-V81 HydrophobicContact CD-CB 3.89Å; K57-V81 HydrophobicContact CD-CG2 3.7Å; K57-V81 HydrophobicContact CG-CG2 4.26Å
58	E	95.3	Very high	97.3	Very high	126 Å²	126	47.7 Å²	47.7	59%	0.589	22%	0.223	S	C	*	.	H	α-helix	trans	-67.6	-46.1	-179.6	-66.4	-52.5	130.4	0	0	111.7	Y54 F56 M60 G61	Y54-E58 WeakPolarHBondContact O-CG 3.29Å; Y54-E58 PolarHBondContact O-N 3.21Å; F56-E58 VanDerWaalsContact C-N 3.32Å; F56-E58 PolarHBondContact O-N 3.19Å; E58-M60 VanDerWaalsContact C-N 3.32Å; E58-M60 PolarHBondContact O-N 2.85Å; E58-G61 PolarHBondContact O-N 3.39Å
59	K	95.5	Very high	97.3	Very high	174 Å²	174	43 Å²	43	76%	0.757	21%	0.206	S	C	*	.	H	α-helix	trans	-59.1	-42.3	178.7	-177.7	-177.7	176.8	-174	0	112.3	T55 F56	T55-K59 WeakPolarHBondContact O-CB 3.46Å; T55-K59 PolarHBondContact O-N 3.2Å; F56-K59 PolarHBondContact O-N 3.43Å
60	M	94.8	Very high	97.3	Very high	42 Å²	42	43 Å²	43	21%	0.207	21%	0.206	C	C	.	.	H	α-helix	trans	-87.7	-10.4	-179	-59.8	-46	-60.4	0	0	113.1	F56 E58 C62 V483 S484	F56-M60 HydrophobicContact CD1-CG 4.12Å; F56-M60 HydrophobicContact CD2-CG 4.08Å; F56-M60 HydrophobicContact CE1-CB 4.42Å; F56-M60 HydrophobicContact CE1-CG 3.81Å; F56-M60 HydrophobicContact CE2-CG 3.75Å; F56-M60 HydrophobicContact CE2-SD 4.5Å; F56-M60 HydrophobicContact CG-CG 4.25Å; F56-M60 HydrophobicContact CZ-CG 3.61Å; F56-M60 WeakPolarHBondContact O-CB 3.35Å; F56-M60 WeakPolarHBondContact O-CG 3.32Å; F56-M60 PolarHBondContact O-N 2.92Å; E58-M60 VanDerWaalsContact C-N 3.32Å; E58-M60 PolarHBondContact O-N 2.85Å; M60-C62 VanDerWaalsContact C-N 3.3Å; M60-C62 PolarHBondContact O-N 2.99Å; M60-V483 HydrophobicContact CB-CG1 4.02Å; M60-V483 HydrophobicContact CE-CG1 4.35Å; M60-V483 HydrophobicContact CG-CG1 4.04Å; M60-S484 WeakPolarHBondContact CE-O 3.37Å; M60-S484 WeakPolarHBondContact CE-OG 3.49Å
61	G	94.2	Very high	97.3	Very high	23 Å²	23	40.7 Å²	40.7	24%	0.237	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	33.1	-175.3	0	0	0	0	0	113.1	K57 E58 P63 R295	K57-G61 CarbonylContact O-C 3.56Å; K57-G61 WeakPolarHBondContact O-CA 3.38Å; K57-G61 PolarHBondContact O-N 3.29Å; E58-G61 PolarHBondContact O-N 3.39Å; G61-P63 WeakPolarHBondContact O-CD 3.45Å; G61-R295 PolarHBondContact O-NH2 3.15Å
62	C	96	Very high	97	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.007	18%	0.181	C	C	.	.			trans	-65	122.7	177.3	-64.2	0	0	0	0	109.6	K57 M60	K57-C62 WeakPolarHBondContact CE-O 3.13Å; K57-C62 HydrophobicContact CG-CB 4.04Å; K57-C62 VanDerWaalsContact CG-O 3.31Å; K57-C62 WeakPolarHBondContact CG-O 3.42Å; K57-C62 PolarHBondContact O-N 3.44Å; M60-C62 VanDerWaalsContact C-N 3.3Å; M60-C62 PolarHBondContact O-N 2.99Å
63	P	97.6	Very high	96.8	Very high	14 Å²	14	34.9 Å²	34.9	9%	0.091	18%	0.184	C	C	.	.	S	Bend	trans	-62.4	-47.2	177.5	-21.7	33.4	0	0	0	111.6	G61 G82 Y83 V86 Y293 L301 N479	G61-P63 WeakPolarHBondContact O-CD 3.45Å; P63-G82 CarbonylContact O-C 3.58Å; P63-G82 VanDerWaalsContact O-CA 3.3Å; P63-G82 WeakPolarHBondContact O-CA 3.3Å; P63-Y83 CarbonylContact C-O 3.57Å; P63-Y83 PolarHBondContact O-N 3.12Å; P63-V86 HydrophobicContact CB-CG2 3.6Å; P63-Y293 HydrophobicContact CB-CD2 3.95Å; P63-Y293 HydrophobicContact CB-CE2 4.18Å; P63-Y293 HydrophobicContact CG-CD2 3.74Å; P63-Y293 HydrophobicContact CG-CE2 4.44Å; P63-Y293 HydrophobicContact CG-CG 4.12Å; P63-L301 HydrophobicContact CB-CD2 4.23Å; P63-L301 HydrophobicContact CG-CD1 3.66Å; P63-L301 HydrophobicContact CG-CD2 3.69Å; P63-L301 HydrophobicContact CG-CG 4.33Å; P63-N479 WeakPolarHBondContact CD-OD1 3.39Å
64	G	98.3	Very high	96.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	144.4	174.7	0	0	0	0	0	111.8	V81 Y83 N479	G64-V81 CarbonylContact C-O 3.57Å; G64-V81 WeakPolarHBondContact CA-O 3.37Å; G64-Y83 VanDerWaalsContact CA-O 3.29Å; G64-Y83 WeakPolarHBondContact CA-O 3.07Å; G64-Y83 PolarHBondContact N-O 3.48Å; G64-N479 WeakPolarHBondContact CA-OD1 3.5Å; G64-N479 PolarHBondContact N-OD1 2.91Å; G64-N479 PolarHBondContact O-N 3.33Å; G64-N479 PolarHBondContact O-OD1 3.44Å
65	M	98.4	Very high	96.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140.7	176.7	-177.5	165.9	79.7	0	0	110.6	V53 F56 K57 V67 G80 V81 I476 L477 T478 L489	V53-M65 HydrophobicContact CB-CE 4.34Å; V53-M65 HydrophobicContact CG1-CE 3.63Å; V53-M65 WeakPolarHBondContact O-CE 3.45Å; F56-M65 HydrophobicContact CD1-CE 4.04Å; F56-M65 HydrophobicContact CD1-SD 3.92Å; F56-M65 HydrophobicContact CE1-SD 4.18Å; K57-M65 HydrophobicContact CB-CE 4.18Å; M65-V67 HydrophobicContact CE-CG2 4.19Å; M65-V67 HydrophobicContact CG-CG2 4.14Å; M65-G80 WeakPolarHBondContact O-CA 3.32Å; M65-V81 HydrophobicContact CB-CG2 3.77Å; M65-V81 HydrophobicContact CE-CG2 4.12Å; M65-V81 PolarHBondContact N-O 3.15Å; M65-V81 PolarHBondContact O-N 3.49Å; M65-I476 HydrophobicContact CG-CG2 3.92Å; M65-I476 HydrophobicContact SD-CG2 3.79Å; M65-L477 CarbonylContact C-O 3.59Å; M65-L477 VanDerWaalsContact CA-O 3.23Å; M65-L477 WeakPolarHBondContact CA-O 3.49Å; M65-T478 HydrophobicContact CB-CG2 4.2Å; M65-T478 HydrophobicContact CG-CG2 3.8Å; M65-T478 HydrophobicContact SD-CG2 3.77Å; M65-L489 HydrophobicContact CE-CD2 4.18Å
66	S	98.6	Very high	96.6	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.014	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132	172.8	-176.8	0	0	0	0	109.5	E79 I476 L477	S66-E79 WeakPolarHBondContact CA-O 3.42Å; S66-I476 CarbonylContact O-C 3.6Å; S66-I476 WeakPolarHBondContact O-CA 3.41Å; S66-L477 PolarHBondContact N-O 3.28Å; S66-L477 PolarHBondContact O-N 3.27Å
67	V	98.7	Very high	96.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	136.8	-179.2	-175.7	0	0	0	0	109	V53 M65 Y77 Q78 E79 A475 I476 L493	V53-V67 HydrophobicContact CG1-CG2 4.05Å; V53-V67 HydrophobicContact CG2-CB 4.39Å; V53-V67 HydrophobicContact CG2-CG1 4.31Å; V53-V67 HydrophobicContact CG2-CG2 3.89Å; M65-V67 HydrophobicContact CE-CG2 4.19Å; M65-V67 HydrophobicContact CG-CG2 4.14Å; V67-Y77 HydrophobicContact CB-CE1 4.15Å; V67-Y77 HydrophobicContact CG1-CD1 4.17Å; V67-Y77 HydrophobicContact CG1-CE1 3.69Å; V67-Q78 WeakPolarHBondContact O-CA 3.41Å; V67-E79 PolarHBondContact N-O 2.77Å; V67-E79 PolarHBondContact O-N 2.93Å; V67-A475 WeakPolarHBondContact CA-O 3.44Å; V67-I476 HydrophobicContact CG1-CG1 4.21Å; V67-I476 HydrophobicContact CG2-CG1 4.33Å; V67-I476 HydrophobicContact CG2-CG2 4.13Å; V67-L493 HydrophobicContact CG1-CD1 3.67Å
68	C	98.6	Very high	96.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	137.4	172.8	-162.6	0	0	0	0	109.6	Y77 A322 I326 A475	C68-Y77 CarbonylContact C-O 3.59Å; C68-Y77 WeakPolarHBondContact CA-O 3.42Å; C68-A322 HydrophobicContact CB-CB 3.64Å; C68-I326 HydrophobicContact CB-CG1 3.69Å; C68-A475 PolarHBondContact N-O 2.89Å; C68-A475 PolarHBondContact O-N 3.07Å
69	V	98.6	Very high	96.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.4	176.3	-176.9	0	0	0	0	109.5	I75 I76 Y77 I472 N473 V474 L493 F497	V69-I75 WeakPolarHBondContact O-CA 3.47Å; V69-I76 HydrophobicContact CB-CG1 4.39Å; V69-I76 HydrophobicContact CG1-CD1 4.22Å; V69-I76 HydrophobicContact CG1-CG1 4.07Å; V69-I76 PolarHBondContact O-N 3.27Å; V69-Y77 HydrophobicContact CG2-CD1 3.97Å; V69-Y77 PolarHBondContact N-O 3.25Å; V69-Y77 PolarHBondContact O-N 2.94Å; V69-I472 HydrophobicContact CG1-CG2 4.09Å; V69-N473 CarbonylContact C-O 3.53Å; V69-N473 VanDerWaalsContact CA-O 3.22Å; V69-N473 WeakPolarHBondContact CA-O 3.07Å; V69-N473 WeakPolarHBondContact CG1-O 3.42Å; V69-V474 HydrophobicContact CG1-CG2 4.23Å; V69-V474 HydrophobicContact CG2-CG1 4.14Å; V69-V474 HydrophobicContact CG2-CG2 4.09Å; V69-L493 HydrophobicContact CG2-CB 4.45Å; V69-F497 HydrophobicContact CB-CD2 4.16Å; V69-F497 HydrophobicContact CB-CE2 4.16Å; V69-F497 HydrophobicContact CG1-CB 4.48Å; V69-F497 HydrophobicContact CG1-CD2 3.64Å; V69-F497 HydrophobicContact CG1-CE2 4.15Å; V69-F497 HydrophobicContact CG1-CG 4.22Å; V69-F497 HydrophobicContact CG2-CD2 4.17Å; V69-F497 HydrophobicContact CG2-CE2 4.03Å
70	S	98.1	Very high	96.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	152.5	167.6	62.2	0	0	0	0	111.8	K74 I326 D330 I472 N473	S70-K74 CarbonylContact C-O 3.37Å; S70-K74 WeakPolarHBondContact CA-O 3.4Å; S70-K74 WeakPolarHBondContact CB-O 3.42Å; S70-I326 WeakPolarHBondContact OG-CG2 3.34Å; S70-D330 WeakPolarHBondContact CB-OD1 3.27Å; S70-D330 PolarHBondContact OG-OD1 2.88Å; S70-D330 PolarHBondContact OG-OD2 3.05Å; S70-I472 VanDerWaalsContact O-CA 3.3Å; S70-I472 WeakPolarHBondContact O-CA 3.4Å; S70-N473 PolarHBondContact N-O 3.44Å; S70-N473 PolarHBondContact O-N 2.97Å; S70-N473 WeakPolarHBondContact OG-CB 3.23Å
71	L	96.4	Very high	96.9	Very high	21 Å²	21	20.6 Å²	20.6	11%	0.11	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.1	168.2	168.9	65.8	0	0	0	107.3	G73 K74 I76 I469 I472 Y500 A501	L71-G73 VanDerWaalsContact C-N 3.28Å; L71-G73 PolarHBondContact O-N 3.07Å; L71-K74 PolarHBondContact N-O 3.15Å; L71-K74 PolarHBondContact O-N 3.38Å; L71-I76 HydrophobicContact CB-CD1 3.67Å; L71-I76 HydrophobicContact CB-CG1 4.26Å; L71-I76 HydrophobicContact CB-CG2 4.06Å; L71-I76 HydrophobicContact CD2-CD1 4.42Å; L71-I469 HydrophobicContact CD1-CG2 4.06Å; L71-I472 HydrophobicContact CD1-CD1 4.08Å; L71-I472 HydrophobicContact CD1-CG1 3.54Å; L71-Y500 HydrophobicContact CD2-CD1 4.23Å; L71-Y500 HydrophobicContact CD2-CE1 4.27Å; L71-A501 HydrophobicContact CD1-CB 4.07Å; L71-A501 HydrophobicContact CD2-CB 3.94Å
72	S	92.6	Very high	97.1	Very high	52 Å²	52	20.7 Å²	20.7	36%	0.364	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	43.7	-178.7	-153.2	0	0	0	0	113.6	K74 P471	S72-K74 PolarHBondContact O-N 2.93Å; S72-P471 PolarHBondContact N-O 2.77Å
73	G	94.2	Very high	97.2	Very high	32 Å²	32	25.6 Å²	25.6	33%	0.33	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	-0	-178.9	0	0	0	0	0	116.5	L71	L71-G73 VanDerWaalsContact C-N 3.28Å; L71-G73 PolarHBondContact O-N 3.07Å
74	K	95.6	Very high	97.2	Very high	108 Å²	108	25.1 Å²	25.1	47%	0.47	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	123.1	173.2	-174.6	177.5	178.1	-178.7	0	109.3	S70 L71 S72 I76	S70-K74 CarbonylContact C-O 3.37Å; S70-K74 WeakPolarHBondContact CA-O 3.4Å; S70-K74 WeakPolarHBondContact CB-O 3.42Å; L71-K74 PolarHBondContact N-O 3.15Å; L71-K74 PolarHBondContact O-N 3.38Å; S72-K74 PolarHBondContact O-N 2.93Å; K74-I76 PolarHBondContact O-N 3.31Å
75	I	96.7	Very high	97.2	Very high	56 Å²	56	26.9 Å²	26.9	29%	0.287	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	119.7	169.4	-64.8	173.7	0	0	0	108.2	V69 Q78 I326	V69-I75 WeakPolarHBondContact O-CA 3.47Å; I75-Q78 HydrophobicContact CG2-CB 4.05Å; I75-I326 HydrophobicContact CG1-CG2 4.17Å
76	I	95.9	Very high	97.2	Very high	5 Å²	5	29.3 Å²	29.3	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-17.2	-179.6	57.5	168.2	0	0	0	113.8	Y34 I42 V69 L71 K74 F497	Y34-I76 WeakPolarHBondContact OH-CA 3.4Å; I42-I76 HydrophobicContact CD1-CB 4.28Å; V69-I76 HydrophobicContact CB-CG1 4.39Å; V69-I76 HydrophobicContact CG1-CD1 4.22Å; V69-I76 HydrophobicContact CG1-CG1 4.07Å; V69-I76 PolarHBondContact O-N 3.27Å; L71-I76 HydrophobicContact CB-CD1 3.67Å; L71-I76 HydrophobicContact CB-CG1 4.26Å; L71-I76 HydrophobicContact CB-CG2 4.06Å; L71-I76 HydrophobicContact CD2-CD1 4.42Å; K74-I76 PolarHBondContact O-N 3.31Å; I76-F497 HydrophobicContact CD1-CB 3.74Å; I76-F497 HydrophobicContact CD1-CD1 3.29Å; I76-F497 HydrophobicContact CD1-CD2 4.24Å; I76-F497 HydrophobicContact CD1-CE1 3.89Å; I76-F497 HydrophobicContact CD1-CG 3.49Å; I76-F497 VanDerWaalsContact CD1-CG 3.49Å; I76-F497 HydrophobicContact CG1-CD1 4.22Å; I76-F497 HydrophobicContact CG1-CE1 4.37Å; I76-F497 HydrophobicContact CG1-CG 4.44Å
77	Y	97.6	Very high	97.1	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	132.6	174.8	170.6	-107.2	0	0	0	109.8	I46 A49 Q50 V53 V67 C68 V69 E79 F497	I46-Y77 HydrophobicContact CG2-CD2 4.26Å; A49-Y77 HydrophobicContact CB-CD1 4.27Å; A49-Y77 HydrophobicContact CB-CD2 4.19Å; A49-Y77 HydrophobicContact CB-CE1 4.08Å; A49-Y77 HydrophobicContact CB-CE2 4.03Å; A49-Y77 HydrophobicContact CB-CG 4.3Å; Q50-Y77 HydrophobicContact CG-CE2 3.76Å; V53-Y77 HydrophobicContact CG2-CE1 4.16Å; V53-Y77 VanDerWaalsContact CG2-OH 3.29Å; V53-Y77 WeakPolarHBondContact CG2-OH 3.49Å; V67-Y77 HydrophobicContact CB-CE1 4.15Å; V67-Y77 HydrophobicContact CG1-CD1 4.17Å; V67-Y77 HydrophobicContact CG1-CE1 3.69Å; C68-Y77 CarbonylContact C-O 3.59Å; C68-Y77 WeakPolarHBondContact CA-O 3.42Å; V69-Y77 HydrophobicContact CG2-CD1 3.97Å; V69-Y77 PolarHBondContact N-O 3.25Å; V69-Y77 PolarHBondContact O-N 2.94Å; Y77-E79 HydrophobicContact CE1-CB 4.42Å; Y77-E79 HydrophobicContact CE2-CB 4.01Å; Y77-E79 PolarHBondContact OH-OE2 3.47Å; Y77-F497 VanDerWaalsContact CB-CZ 3.49Å; Y77-F497 HydrophobicContact CD1-CE2 4.25Å; Y77-F497 HydrophobicContact CD1-CZ 4.46Å; Y77-F497 HydrophobicContact CG-CE2 4.21Å; Y77-F497 AromaticContact CG-CZ 3.98Å; Y77-F497 HydrophobicContact CG-CZ 3.98Å
78	Q	97.6	Very high	97	Very high	62 Å²	62	40.7 Å²	40.7	29%	0.29	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	123.4	176.8	-174.2	176.1	19.2	0	0	109.5	V67 I75 E94	V67-Q78 WeakPolarHBondContact O-CA 3.41Å; I75-Q78 HydrophobicContact CG2-CB 4.05Å; Q78-E94 VanDerWaalsContact NE2-CB 3.27Å
79	E	96.2	Very high	96.9	Very high	21 Å²	21	47 Å²	47	10%	0.098	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	137.5	-178	-161.5	166.5	-143.2	0	0	111.9	Q50 Y54 S66 V67 Y77 V81	Q50-E79 WeakPolarHBondContact CG-OE2 3.12Å; Q50-E79 PolarHBondContact NE2-OE1 3.36Å; Y54-E79 VanDerWaalsContact CE2-OE1 3.31Å; Y54-E79 WeakPolarHBondContact CE2-OE1 3.13Å; Y54-E79 PolarHBondContact OH-OE1 2.61Å; S66-E79 WeakPolarHBondContact CA-O 3.42Å; V67-E79 PolarHBondContact N-O 2.77Å; V67-E79 PolarHBondContact O-N 2.93Å; Y77-E79 HydrophobicContact CE1-CB 4.42Å; Y77-E79 HydrophobicContact CE2-CB 4.01Å; Y77-E79 PolarHBondContact OH-OE2 3.47Å; E79-V81 HydrophobicContact CG-CG1 3.81Å
80	G	98	Very high	96.9	Very high	29 Å²	29	50.1 Å²	50.1	30%	0.299	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.1	164.7	0	0	0	0	0	108.6	M65	M65-G80 WeakPolarHBondContact O-CA 3.32Å
81	V	97.6	Very high	96.9	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.1	179.8	-64.3	0	0	0	0	110.7	V53 Y54 K57 G64 M65 E79	V53-V81 HydrophobicContact CG1-CG1 3.93Å; V53-V81 HydrophobicContact CG1-CG2 3.93Å; Y54-V81 HydrophobicContact CD1-CG1 4.3Å; Y54-V81 HydrophobicContact CD2-CG1 4.42Å; Y54-V81 HydrophobicContact CE1-CB 4.3Å; Y54-V81 HydrophobicContact CE1-CG1 3.78Å; Y54-V81 HydrophobicContact CE2-CG1 3.9Å; K57-V81 HydrophobicContact CB-CG2 4.3Å; K57-V81 HydrophobicContact CD-CB 3.89Å; K57-V81 HydrophobicContact CD-CG2 3.7Å; K57-V81 HydrophobicContact CG-CG2 4.26Å; G64-V81 CarbonylContact C-O 3.57Å; G64-V81 WeakPolarHBondContact CA-O 3.37Å; M65-V81 HydrophobicContact CB-CG2 3.77Å; M65-V81 HydrophobicContact CE-CG2 4.12Å; M65-V81 PolarHBondContact N-O 3.15Å; M65-V81 PolarHBondContact O-N 3.49Å; E79-V81 HydrophobicContact CG-CG1 3.81Å
82	G	97.8	Very high	97	Very high	26 Å²	26	53.3 Å²	53.3	27%	0.268	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.1	-149	-179.5	0	0	0	0	0	114	P63 P91 V92	P63-G82 CarbonylContact O-C 3.58Å; P63-G82 VanDerWaalsContact O-CA 3.3Å; P63-G82 WeakPolarHBondContact O-CA 3.3Å; G82-P91 WeakPolarHBondContact O-CA 3.49Å; G82-V92 PolarHBondContact O-N 2.93Å
83	Y	98.3	Very high	97.2	Very high	104 Å²	104	53.5 Å²	53.5	41%	0.408	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.3	-169.8	-58.8	-73	0	0	0	112.6	P63 G64 M89 V90 N479	P63-Y83 CarbonylContact C-O 3.57Å; P63-Y83 PolarHBondContact O-N 3.12Å; G64-Y83 VanDerWaalsContact CA-O 3.29Å; G64-Y83 WeakPolarHBondContact CA-O 3.07Å; G64-Y83 PolarHBondContact N-O 3.48Å; Y83-M89 VanDerWaalsContact CD1-C 3.41Å; Y83-M89 HydrophobicContact CD1-CB 4.17Å; Y83-M89 HydrophobicContact CE1-CB 3.83Å; Y83-M89 HydrophobicContact CE1-CG 4.43Å; Y83-V90 CarbonylContact C-O 3.58Å; Y83-V90 WeakPolarHBondContact CA-O 3.23Å; Y83-N479 PolarHBondContact O-ND2 2.87Å
84	A	98.3	Very high	97.2	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.033	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	-33.1	166.3	0	0	0	0	0	110.9	V90 V92 T96 A290 A291 N479	A84-V90 HydrophobicContact CB-CG1 4.32Å; A84-V90 PolarHBondContact N-O 2.75Å; A84-V92 HydrophobicContact CB-CG2 4.2Å; A84-T96 HydrophobicContact CB-CG2 3.61Å; A84-A290 HydrophobicContact CB-CB 4.37Å; A84-A290 CarbonylContact O-C 3.6Å; A84-A290 WeakPolarHBondContact O-CA 3.17Å; A84-A291 PolarHBondContact O-N 3.1Å; A84-N479 PolarHBondContact O-ND2 3.36Å
85	N	98.1	Very high	97.3	Very high	36 Å²	36	52.7 Å²	52.7	19%	0.193	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	116.6	172	-178.3	-60.6	0	0	0	108.9	E87 H88 M89 V90 A291 Y293	N85-E87 PolarHBondContact OD1-N 3.46Å; N85-E87 VanDerWaalsContact OD1-N 3.11Å; N85-E87 PolarHBondContact OD1-OE2 3.34Å; N85-H88 WeakPolarHBondContact OD1-CB 3.31Å; N85-H88 PolarHBondContact OD1-CD2 2.87Å; N85-H88 PolarHBondContact OD1-N 2.82Å; N85-M89 CarbonylContact O-C 3.51Å; N85-M89 WeakPolarHBondContact O-CA 3.36Å; N85-M89 PolarHBondContact O-N 2.86Å; N85-V90 HydrophobicContact CB-CB 4.12Å; N85-V90 HydrophobicContact CB-CG2 4.21Å; N85-V90 PolarHBondContact N-O 2.8Å; N85-V90 PolarHBondContact O-N 2.7Å; N85-A291 HydrophobicContact CB-CB 4.24Å; N85-Y293 WeakPolarHBondContact CA-OH 3.44Å
86	V	97.6	Very high	97.4	Very high	52 Å²	52	50.1 Å²	50.1	32%	0.315	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-45.4	-177.3	177.8	0	0	0	0	111.1	P63 H88 M89 Y293 L301	P63-V86 HydrophobicContact CB-CG2 3.6Å; V86-H88 PolarHBondContact O-N 3.23Å; V86-M89 PolarHBondContact O-N 3.05Å; V86-M89 VanDerWaalsContact O-N 3.16Å; V86-Y293 HydrophobicContact CB-CE1 4.39Å; V86-Y293 HydrophobicContact CG2-CE1 4.3Å; V86-Y293 HydrophobicContact CG2-CE2 3.84Å; V86-Y293 PolarHBondContact N-OH 3.5Å; V86-L301 HydrophobicContact CG2-CD2 4.02Å
87	E	96.3	Very high	97.5	Very high	97 Å²	97	50 Å²	50	45%	0.453	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-35.4	-177.8	-67.8	83.5	172.8	0	0	112.4	N85 Y293 N303	N85-E87 PolarHBondContact OD1-N 3.46Å; N85-E87 VanDerWaalsContact OD1-N 3.11Å; N85-E87 PolarHBondContact OD1-OE2 3.34Å; E87-Y293 PolarHBondContact OE2-OH 3.29Å; E87-N303 PolarHBondContact OE1-ND2 3.03Å; E87-N303 PolarHBondContact OE1-OD1 2.89Å
88	H	96.9	Very high	97.5	Very high	143 Å²	143	50 Å²	50	66%	0.662	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	5.6	-178.6	-61.9	-62.7	0	0	0	113.5	N85 V86 V90	N85-H88 WeakPolarHBondContact OD1-CB 3.31Å; N85-H88 PolarHBondContact OD1-CD2 2.87Å; N85-H88 PolarHBondContact OD1-N 2.82Å; V86-H88 PolarHBondContact O-N 3.23Å; H88-V90 HydrophobicContact CB-CG2 3.92Å; H88-V90 PolarHBondContact O-N 2.9Å; H88-V90 VanDerWaalsContact O-N 3.15Å
89	M	96.8	Very high	97.5	Very high	132 Å²	132	47.7 Å²	47.7	65%	0.65	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	37.5	-178	-59.8	-177.8	-71.2	0	0	113.6	Y83 N85 V86 P91	Y83-M89 VanDerWaalsContact CD1-C 3.41Å; Y83-M89 HydrophobicContact CD1-CB 4.17Å; Y83-M89 HydrophobicContact CE1-CB 3.83Å; Y83-M89 HydrophobicContact CE1-CG 4.43Å; N85-M89 CarbonylContact O-C 3.51Å; N85-M89 WeakPolarHBondContact O-CA 3.36Å; N85-M89 PolarHBondContact O-N 2.86Å; V86-M89 PolarHBondContact O-N 3.05Å; V86-M89 VanDerWaalsContact O-N 3.16Å; M89-P91 WeakPolarHBondContact O-CD 3.26Å
90	V	98.3	Very high	97.6	Very high	66 Å²	66	46.7 Å²	46.7	40%	0.4	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	117.3	178.5	179.7	0	0	0	0	108.2	Y83 A84 N85 H88	Y83-V90 CarbonylContact C-O 3.58Å; Y83-V90 WeakPolarHBondContact CA-O 3.23Å; A84-V90 HydrophobicContact CB-CG1 4.32Å; A84-V90 PolarHBondContact N-O 2.75Å; N85-V90 HydrophobicContact CB-CB 4.12Å; N85-V90 HydrophobicContact CB-CG2 4.21Å; N85-V90 PolarHBondContact N-O 2.8Å; N85-V90 PolarHBondContact O-N 2.7Å; H88-V90 HydrophobicContact CB-CG2 3.92Å; H88-V90 PolarHBondContact O-N 2.9Å; H88-V90 VanDerWaalsContact O-N 3.15Å
91	P	98.3	Very high	97.5	Very high	79 Å²	79	45.4 Å²	45.4	51%	0.513	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	147.8	-178.4	28.9	-34.8	0	0	0	111.5	G82 M89	G82-P91 WeakPolarHBondContact O-CA 3.49Å; M89-P91 WeakPolarHBondContact O-CD 3.26Å
92	V	98.6	Very high	97.5	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-66.4	134.3	167.2	-179.4	0	0	0	0	109.2	G82 A84 T96 F98	G82-V92 PolarHBondContact O-N 2.93Å; A84-V92 HydrophobicContact CB-CG2 4.2Å; V92-T96 HydrophobicContact CG1-CG2 4.37Å; V92-F98 HydrophobicContact CG1-CE2 4.1Å; V92-F98 HydrophobicContact CG1-CZ 3.85Å; V92-F98 HydrophobicContact CG2-CZ 4.02Å
93	N	96.8	Very high	97.5	Very high	55 Å²	55	44.6 Å²	44.6	29%	0.294	23%	0.228	S	C	.	.			trans	-135	179.6	173.3	65.9	56.3	0	0	0	111	N95 T96	N93-N95 PolarHBondContact O-N 3.15Å; N93-N95 VanDerWaalsContact O-N 3.13Å; N93-N95 WeakPolarHBondContact OD1-CA 3.42Å; N93-N95 WeakPolarHBondContact OD1-CB 3.42Å; N93-N95 PolarHBondContact OD1-N 3.12Å; N93-T96 PolarHBondContact N-OG1 3.42Å; N93-T96 WeakPolarHBondContact O-CB 3.39Å; N93-T96 PolarHBondContact O-N 2.63Å; N93-T96 PolarHBondContact O-OG1 2.7Å; N93-T96 PolarHBondContact OD1-N 2.53Å
94	E	94.7	Very high	97.5	Very high	59 Å²	59	39.7 Å²	39.7	28%	0.276	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.3	-177.4	64	-83.5	-165	0	0	114.8	R30 Q78 T321	R30-E94 IonicContact CZ-OE1 3.9Å; R30-E94 IonicContact NH1-OE1 3.03Å; R30-E94 PolarHBondContact NH1-OE1 3.49Å; R30-E94 IonicContact NH1-OE2 3.68Å; R30-E94 PolarHBondContact NH1-OE2 3Å; R30-E94 VanDerWaalsContact NH1-OE2 3.14Å; R30-E94 IonicContact NH2-OE1 3.96Å; Q78-E94 VanDerWaalsContact NE2-CB 3.27Å; E94-T321 WeakPolarHBondContact O-CG2 3.42Å
95	N	97	Very high	97.5	Very high	64 Å²	64	39.5 Å²	39.5	34%	0.342	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	0.3	-179.1	-57.8	-53	0	0	0	112.5	N93 V97 S288	N93-N95 PolarHBondContact O-N 3.15Å; N93-N95 VanDerWaalsContact O-N 3.13Å; N93-N95 WeakPolarHBondContact OD1-CA 3.42Å; N93-N95 WeakPolarHBondContact OD1-CB 3.42Å; N93-N95 PolarHBondContact OD1-N 3.12Å; N95-V97 PolarHBondContact O-N 3.3Å; N95-S288 WeakPolarHBondContact O-CB 3.42Å
96	T	98.4	Very high	97.5	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	20%	0.198	C	C	.	.			trans	-66.7	119.9	176.9	-58.3	0	0	0	0	110.2	A84 V92 N93 F98 S288 A290	A84-T96 HydrophobicContact CB-CG2 3.61Å; V92-T96 HydrophobicContact CG1-CG2 4.37Å; N93-T96 PolarHBondContact N-OG1 3.42Å; N93-T96 WeakPolarHBondContact O-CB 3.39Å; N93-T96 PolarHBondContact O-N 2.63Å; N93-T96 PolarHBondContact O-OG1 2.7Å; N93-T96 PolarHBondContact OD1-N 2.53Å; T96-F98 HydrophobicContact CG2-CD2 4.1Å; T96-F98 HydrophobicContact CG2-CE2 3.42Å; T96-F98 VanDerWaalsContact CG2-CE2 3.42Å; T96-F98 HydrophobicContact CG2-CZ 3.67Å; T96-F98 WeakPolarHBondContact O-CD2 3.47Å; T96-S288 WeakPolarHBondContact CA-O 3.41Å; T96-A290 HydrophobicContact CG2-CB 3.83Å
97	V	98.3	Very high	97.6	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.024	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-93.6	132.8	177.9	-60.4	0	0	0	0	110.9	N95 N276 I286 S288 R289 A290 L319 S320 T321	N95-V97 PolarHBondContact O-N 3.3Å; V97-N276 HydrophobicContact CG1-CB 3.82Å; V97-N276 WeakPolarHBondContact CG1-O 3.36Å; V97-I286 HydrophobicContact CG2-CG2 3.74Å; V97-S288 PolarHBondContact N-O 2.71Å; V97-R289 HydrophobicContact CG2-CB 4.14Å; V97-A290 PolarHBondContact O-N 2.71Å; V97-L319 HydrophobicContact CB-CB 4.28Å; V97-L319 HydrophobicContact CG2-CB 4.4Å; V97-L319 HydrophobicContact CG2-CD1 4.32Å; V97-S320 WeakPolarHBondContact CA-O 3.46Å; V97-T321 HydrophobicContact CG1-CG2 3.91Å
98	F	98.4	Very high	97.7	Very high	3 Å²	3	30.7 Å²	30.7	1%	0.013	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	156	178.5	-64.2	-101.3	0	0	0	110	V92 T96 I100 A290 L319 S320 L477 N479	V92-F98 HydrophobicContact CG1-CE2 4.1Å; V92-F98 HydrophobicContact CG1-CZ 3.85Å; V92-F98 HydrophobicContact CG2-CZ 4.02Å; T96-F98 HydrophobicContact CG2-CD2 4.1Å; T96-F98 HydrophobicContact CG2-CE2 3.42Å; T96-F98 VanDerWaalsContact CG2-CE2 3.42Å; T96-F98 HydrophobicContact CG2-CZ 3.67Å; T96-F98 WeakPolarHBondContact O-CD2 3.47Å; F98-I100 PolarHBondContact O-N 3.05Å; F98-A290 HydrophobicContact CD1-CB 3.68Å; F98-A290 HydrophobicContact CE1-CB 3.67Å; F98-A290 HydrophobicContact CG-CB 4.18Å; F98-A290 HydrophobicContact CZ-CB 4.16Å; F98-L319 CarbonylContact O-C 3.52Å; F98-L319 VanDerWaalsContact O-CA 3.24Å; F98-L319 WeakPolarHBondContact O-CA 3.21Å; F98-S320 PolarHBondContact N-O 3.44Å; F98-S320 PolarHBondContact O-N 3.14Å; F98-L477 HydrophobicContact CB-CB 3.92Å; F98-L477 HydrophobicContact CB-CD1 4.19Å; F98-L477 HydrophobicContact CD1-CB 4.42Å; F98-L477 HydrophobicContact CD2-CB 3.77Å; F98-L477 HydrophobicContact CD2-CD1 4.03Å; F98-L477 HydrophobicContact CE2-CB 4.39Å; F98-L477 HydrophobicContact CG-CB 3.79Å; F98-L477 HydrophobicContact CG-CD1 4.45Å; F98-N479 HydrophobicContact CD1-CB 3.93Å; F98-N479 HydrophobicContact CE1-CB 3.8Å
99	R	97.4	Very high	97.8	Very high	13 Å²	13	23.9 Å²	23.9	5%	0.049	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	117	165.5	-74.6	179.3	174.6	155.1	5.9	108.8	E280 L319 A401 V402 T406	R99-E280 IonicContact CZ-OE1 3.7Å; R99-E280 IonicContact CZ-OE2 3.22Å; R99-E280 VanDerWaalsContact NE-CD 3.35Å; R99-E280 IonicContact NE-OE1 3.39Å; R99-E280 PolarHBondContact NE-OE1 2.64Å; R99-E280 IonicContact NE-OE2 2.88Å; R99-E280 PolarHBondContact NE-OE2 2.8Å; R99-E280 IonicContact NH2-OE1 2.57Å; R99-E280 PolarHBondContact NH2-OE1 2.99Å; R99-E280 IonicContact NH2-OE2 2.79Å; R99-L319 HydrophobicContact CB-CD2 4.13Å; R99-L319 HydrophobicContact CG-CD2 3.48Å; R99-L319 VanDerWaalsContact CG-CD2 3.48Å; R99-A401 HydrophobicContact CB-CB 4.24Å; R99-V402 VanDerWaalsContact CD-O 3.27Å; R99-V402 WeakPolarHBondContact CD-O 3.42Å; R99-V402 PolarHBondContact NH1-O 3.3Å; R99-T406 VanDerWaalsContact O-CG2 3.22Å; R99-T406 WeakPolarHBondContact O-CG2 3.45Å
100	I	98	Very high	97.8	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.			trans	-90.3	-5.1	178.5	71.2	171.4	0	0	0	113.6	F98 S102 I103 F107 I318 S320 L325 T406 L477	F98-I100 PolarHBondContact O-N 3.05Å; I100-S102 PolarHBondContact O-N 3.35Å; I100-I103 HydrophobicContact CB-CB 4.11Å; I100-I103 HydrophobicContact CB-CD1 4.48Å; I100-I103 HydrophobicContact CD1-CB 4.07Å; I100-I103 HydrophobicContact CD1-CG2 4.01Å; I100-I103 HydrophobicContact CG1-CB 4.19Å; I100-I103 WeakPolarHBondContact O-CB 3.38Å; I100-I103 WeakPolarHBondContact O-CG1 3.34Å; I100-I103 PolarHBondContact O-N 2.75Å; I100-I103 VanDerWaalsContact O-N 3.16Å; I100-F107 HydrophobicContact CD1-CD2 4.48Å; I100-F107 HydrophobicContact CD1-CE2 3.74Å; I100-F107 HydrophobicContact CD1-CZ 4.46Å; I100-I318 HydrophobicContact CD1-CB 3.83Å; I100-I318 HydrophobicContact CD1-CG2 3.59Å; I100-I318 HydrophobicContact CG1-CB 3.87Å; I100-I318 HydrophobicContact CG1-CG2 4.01Å; I100-I318 WeakPolarHBondContact CG1-O 3.32Å; I100-I318 PolarHBondContact N-O 2.83Å; I100-I318 VanDerWaalsContact N-O 3.08Å; I100-S320 VanDerWaalsContact CG2-CB 3.49Å; I100-L325 HydrophobicContact CD1-CD2 3.95Å; I100-L325 HydrophobicContact CG2-CD1 4.17Å; I100-T406 PolarHBondContact O-OG1 3.12Å; I100-L477 HydrophobicContact CG2-CD1 4.42Å; I100-L477 HydrophobicContact CG2-CD2 4Å
101	A	95.4	Very high	97.8	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.008	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	49.8	-131.7	175.2	0	0	0	0	0	111.5	I103 S104 G316 G400 A401	A101-I103 PolarHBondContact O-N 2.59Å; A101-S104 VanDerWaalsContact O-CB 3.28Å; A101-S104 WeakPolarHBondContact O-CB 3.17Å; A101-S104 PolarHBondContact O-N 3.06Å; A101-S104 PolarHBondContact O-OG 3.45Å; A101-G316 WeakPolarHBondContact O-CA 3.37Å; A101-G400 VanDerWaalsContact CB-C 3.43Å; A101-G400 WeakPolarHBondContact CB-O 3.33Å; A101-A401 HydrophobicContact CB-CB 3.51Å
102	S	97.5	Very high	97.9	Very high	13 Å²	13	10.7 Å²	10.7	9%	0.091	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-63.1	-9.1	-175.2	-62.2	0	0	0	0	116.1	I100 S104 K105 Y207 G315 H397 T398	I100-S102 PolarHBondContact O-N 3.35Å; S102-S104 PolarHBondContact O-N 3.15Å; S102-K105 WeakPolarHBondContact O-CB 3.19Å; S102-K105 WeakPolarHBondContact O-CG 3.49Å; S102-K105 PolarHBondContact O-N 2.98Å; S102-K105 PolarHBondContact OG-NZ 2.84Å; S102-Y207 WeakPolarHBondContact CB-OH 3.18Å; S102-Y207 PolarHBondContact OG-OH 2.83Å; S102-G315 WeakPolarHBondContact CA-O 3.38Å; S102-H397 WeakPolarHBondContact CB-CE1 3.37Å; S102-H397 PolarHBondContact O-CE1 3.38Å; S102-H397 PolarHBondContact O-ND1 3.28Å; S102-T398 WeakPolarHBondContact CB-O 3.41Å
103	I	98.4	Very high	97.8	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-59.9	-15.2	164.7	-57.1	176.4	0	0	0	110.9	I100 A101 K105 P106 F107 L325 T406 L408	I100-I103 HydrophobicContact CB-CB 4.11Å; I100-I103 HydrophobicContact CB-CD1 4.48Å; I100-I103 HydrophobicContact CD1-CB 4.07Å; I100-I103 HydrophobicContact CD1-CG2 4.01Å; I100-I103 HydrophobicContact CG1-CB 4.19Å; I100-I103 WeakPolarHBondContact O-CB 3.38Å; I100-I103 WeakPolarHBondContact O-CG1 3.34Å; I100-I103 PolarHBondContact O-N 2.75Å; I100-I103 VanDerWaalsContact O-N 3.16Å; A101-I103 PolarHBondContact O-N 2.59Å; I103-K105 PolarHBondContact O-N 3.19Å; I103-P106 WeakPolarHBondContact O-CB 3.48Å; I103-P106 WeakPolarHBondContact O-CD 3.28Å; I103-P106 WeakPolarHBondContact O-CG 3.41Å; I103-F107 WeakPolarHBondContact O-CD2 3.48Å; I103-L325 HydrophobicContact CD1-CD1 4.03Å; I103-L325 HydrophobicContact CG2-CD1 4.2Å; I103-L325 HydrophobicContact CG2-CD2 4.03Å; I103-T406 VanDerWaalsContact CD1-OG1 3.23Å; I103-T406 WeakPolarHBondContact CD1-OG1 3.24Å; I103-L408 HydrophobicContact CD1-CB 4.06Å; I103-L408 HydrophobicContact CG2-CB 4.23Å; I103-L408 HydrophobicContact CG2-CD2 4.18Å
104	S	98.6	Very high	97.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-60.9	-26.6	169.2	-48.7	0	0	0	0	113.8	A101 S102 F107 T108 W313 A314 G317 I318	A101-S104 VanDerWaalsContact O-CB 3.28Å; A101-S104 WeakPolarHBondContact O-CB 3.17Å; A101-S104 PolarHBondContact O-N 3.06Å; A101-S104 PolarHBondContact O-OG 3.45Å; S102-S104 PolarHBondContact O-N 3.15Å; S104-F107 WeakPolarHBondContact O-CB 3.42Å; S104-F107 PolarHBondContact O-N 2.91Å; S104-F107 VanDerWaalsContact O-N 3.15Å; S104-T108 PolarHBondContact O-N 3.1Å; S104-W313 WeakPolarHBondContact CB-O 3.4Å; S104-A314 CarbonylContact C-O 3.52Å; S104-G317 PolarHBondContact OG-N 2.98Å; S104-I318 WeakPolarHBondContact OG-CB 3.45Å; S104-I318 PolarHBondContact OG-N 2.91Å
105	K	98.6	Very high	97.9	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-64.1	-45.2	-178.4	-67.1	-176.6	173.9	68.8	0	112.8	S102 I103 F107 T108 S109 Y207 F212 G315	S102-K105 WeakPolarHBondContact O-CB 3.19Å; S102-K105 WeakPolarHBondContact O-CG 3.49Å; S102-K105 PolarHBondContact O-N 2.98Å; S102-K105 PolarHBondContact OG-NZ 2.84Å; I103-K105 PolarHBondContact O-N 3.19Å; K105-F107 VanDerWaalsContact C-N 3.28Å; K105-F107 PolarHBondContact O-N 3.46Å; K105-T108 PolarHBondContact O-N 3.38Å; K105-T108 VanDerWaalsContact O-N 3.13Å; K105-S109 WeakPolarHBondContact O-CB 3.42Å; K105-S109 PolarHBondContact O-N 2.98Å; K105-Y207 HydrophobicContact CD-CE2 4.4Å; K105-Y207 WeakPolarHBondContact CD-OH 3.5Å; K105-Y207 WeakPolarHBondContact CE-OH 3.25Å; K105-Y207 PolarHBondContact NZ-OH 3.35Å; K105-F212 HydrophobicContact CB-CD1 3.99Å; K105-F212 HydrophobicContact CB-CE1 3.44Å; K105-F212 VanDerWaalsContact CB-CE1 3.44Å; K105-F212 HydrophobicContact CB-CE2 4.43Å; K105-F212 HydrophobicContact CB-CZ 3.7Å; K105-F212 HydrophobicContact CD-CD1 4.31Å; K105-F212 HydrophobicContact CD-CD2 3.83Å; K105-F212 HydrophobicContact CD-CE1 4.08Å; K105-F212 HydrophobicContact CD-CE2 3.6Å; K105-F212 HydrophobicContact CD-CG 4.19Å; K105-F212 HydrophobicContact CD-CZ 3.72Å; K105-F212 HydrophobicContact CG-CD1 3.64Å; K105-F212 HydrophobicContact CG-CD2 4.06Å; K105-F212 HydrophobicContact CG-CE1 3.55Å; K105-F212 HydrophobicContact CG-CE2 4Å; K105-F212 HydrophobicContact CG-CG 3.89Å; K105-F212 HydrophobicContact CG-CZ 3.74Å; K105-G315 PolarHBondContact NZ-O 2.98Å
106	P	98.3	Very high	97.9	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-43.3	-45.2	164.2	-40.8	38.9	0	0	0	115.8	I103 S109 L110 G372 W373 H397	I103-P106 WeakPolarHBondContact O-CB 3.48Å; I103-P106 WeakPolarHBondContact O-CD 3.28Å; I103-P106 WeakPolarHBondContact O-CG 3.41Å; P106-S109 WeakPolarHBondContact O-CB 3.12Å; P106-S109 PolarHBondContact O-N 3.28Å; P106-L110 WeakPolarHBondContact O-CG 3.04Å; P106-L110 PolarHBondContact O-N 3.32Å; P106-G372 VanDerWaalsContact CD-O 3.26Å; P106-G372 WeakPolarHBondContact CD-O 3.25Å; P106-W373 HydrophobicContact CB-CD2 4.28Å; P106-W373 HydrophobicContact CB-CE3 4.35Å; P106-W373 HydrophobicContact CB-CH2 3.57Å; P106-W373 HydrophobicContact CB-CZ2 3.47Å; P106-W373 VanDerWaalsContact CB-CZ2 3.47Å; P106-W373 HydrophobicContact CB-CZ3 4.02Å; P106-W373 HydrophobicContact CG-CD2 4.08Å; P106-W373 HydrophobicContact CG-CE3 3.97Å; P106-W373 HydrophobicContact CG-CH2 4.03Å; P106-W373 HydrophobicContact CG-CZ2 4.15Å; P106-W373 HydrophobicContact CG-CZ3 3.94Å; P106-H397 HydrophobicContact CG-CB 3.8Å
107	F	98.6	Very high	97.8	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-65.2	-44.6	178.9	-68.9	-95.3	0	0	0	111.8	I100 I103 S104 K105 S109 L110 L111 L265 L268 F269 L274 T277 I318 L325 L328	I100-F107 HydrophobicContact CD1-CD2 4.48Å; I100-F107 HydrophobicContact CD1-CE2 3.74Å; I100-F107 HydrophobicContact CD1-CZ 4.46Å; I103-F107 WeakPolarHBondContact O-CD2 3.48Å; S104-F107 WeakPolarHBondContact O-CB 3.42Å; S104-F107 PolarHBondContact O-N 2.91Å; S104-F107 VanDerWaalsContact O-N 3.15Å; K105-F107 VanDerWaalsContact C-N 3.28Å; K105-F107 PolarHBondContact O-N 3.46Å; F107-S109 VanDerWaalsContact C-N 3.32Å; F107-S109 PolarHBondContact O-N 3.16Å; F107-L110 PolarHBondContact O-N 2.93Å; F107-L111 PolarHBondContact O-N 3.02Å; F107-L265 HydrophobicContact CB-CD2 3.93Å; F107-L268 HydrophobicContact CB-CD2 4Å; F107-L268 HydrophobicContact CD1-CD2 3.87Å; F107-L268 HydrophobicContact CD1-CG 4.46Å; F107-L268 HydrophobicContact CG-CD2 4.44Å; F107-L268 WeakPolarHBondContact O-CD2 3.39Å; F107-F269 AromaticContact CD1-CD1 3.92Å; F107-F269 HydrophobicContact CD1-CD1 3.92Å; F107-F269 AromaticContact CD1-CE1 3.51Å; F107-F269 HydrophobicContact CD1-CE1 3.51Å; F107-F269 AromaticContact CE1-CD1 3.82Å; F107-F269 HydrophobicContact CE1-CD1 3.82Å; F107-F269 AromaticContact CE1-CE1 3.67Å; F107-F269 HydrophobicContact CE1-CE1 3.67Å; F107-F269 HydrophobicContact CG-CE1 4.23Å; F107-L274 HydrophobicContact CE1-CD1 3.56Å; F107-L274 HydrophobicContact CZ-CD1 4.09Å; F107-T277 HydrophobicContact CE1-CG2 4.49Å; F107-T277 HydrophobicContact CZ-CG2 4.37Å; F107-I318 HydrophobicContact CB-CD1 4.08Å; F107-I318 HydrophobicContact CD2-CD1 3.9Å; F107-I318 HydrophobicContact CE2-CD1 4.46Å; F107-I318 HydrophobicContact CG-CD1 3.95Å; F107-L325 HydrophobicContact CE2-CD2 4.13Å; F107-L325 HydrophobicContact CZ-CD2 4.09Å; F107-L328 HydrophobicContact CD2-CD2 4.38Å; F107-L328 HydrophobicContact CE1-CD2 4.04Å; F107-L328 HydrophobicContact CE2-CD2 3.76Å; F107-L328 HydrophobicContact CZ-CD2 3.6Å
108	T	98.6	Very high	97.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-62.8	-40.3	175.6	-55.1	0	0	0	0	111.6	S104 K105 L110 L111 V112 F212 L215 I219 F261 A314	S104-T108 PolarHBondContact O-N 3.1Å; K105-T108 PolarHBondContact O-N 3.38Å; K105-T108 VanDerWaalsContact O-N 3.13Å; T108-L110 VanDerWaalsContact C-N 3.29Å; T108-L110 PolarHBondContact O-N 3.35Å; T108-L111 WeakPolarHBondContact O-CB 3.46Å; T108-L111 PolarHBondContact O-N 2.94Å; T108-L111 VanDerWaalsContact O-N 3.17Å; T108-V112 PolarHBondContact O-N 2.98Å; T108-V112 VanDerWaalsContact O-N 3.09Å; T108-F212 HydrophobicContact CG2-CD1 4.05Å; T108-F212 HydrophobicContact CG2-CE1 4.4Å; T108-L215 HydrophobicContact CG2-CD2 3.68Å; T108-L215 HydrophobicContact CG2-CG 4.06Å; T108-I219 HydrophobicContact CG2-CD1 3.87Å; T108-F261 HydrophobicContact CG2-CE2 4.16Å; T108-F261 HydrophobicContact CG2-CZ 4.09Å; T108-A314 HydrophobicContact CG2-CB 4.18Å; T108-A314 WeakPolarHBondContact OG1-CA 3.23Å; T108-A314 PolarHBondContact OG1-O 3.04Å
109	S	98.5	Very high	97.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.9	-41.6	173.9	172.5	0	0	0	0	111.9	K105 P106 F107 V112 G113 L371 W373	K105-S109 WeakPolarHBondContact O-CB 3.42Å; K105-S109 PolarHBondContact O-N 2.98Å; P106-S109 WeakPolarHBondContact O-CB 3.12Å; P106-S109 PolarHBondContact O-N 3.28Å; F107-S109 VanDerWaalsContact C-N 3.32Å; F107-S109 PolarHBondContact O-N 3.16Å; S109-V112 PolarHBondContact O-N 3.35Å; S109-G113 PolarHBondContact O-N 3.1Å; S109-L371 VanDerWaalsContact CB-O 3.23Å; S109-L371 WeakPolarHBondContact CB-O 3.43Å; S109-L371 PolarHBondContact OG-O 3Å; S109-W373 PolarHBondContact OG-NE1 3.47Å
110	L	98.2	Very high	97.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67.1	-36.1	175.8	-65.8	175.2	0	0	0	113.5	P106 F107 T108 V112 G113 R114 L268 L328 L332 I345 V346 L355	P106-L110 WeakPolarHBondContact O-CG 3.04Å; P106-L110 PolarHBondContact O-N 3.32Å; F107-L110 PolarHBondContact O-N 2.93Å; T108-L110 VanDerWaalsContact C-N 3.29Å; T108-L110 PolarHBondContact O-N 3.35Å; L110-V112 VanDerWaalsContact C-N 3.3Å; L110-V112 PolarHBondContact O-N 3.4Å; L110-G113 PolarHBondContact O-N 2.69Å; L110-R114 WeakPolarHBondContact O-CB 3.47Å; L110-R114 PolarHBondContact O-N 2.93Å; L110-L268 HydrophobicContact CB-CD2 4.34Å; L110-L328 HydrophobicContact CD1-CD1 3.64Å; L110-L332 HydrophobicContact CD1-CD1 4.39Å; L110-L332 HydrophobicContact CD1-CD2 4.02Å; L110-L332 HydrophobicContact CD2-CD2 3.53Å; L110-L332 HydrophobicContact CG-CD2 4.4Å; L110-I345 HydrophobicContact CD1-CG2 4.34Å; L110-I345 HydrophobicContact CD2-CG2 4.1Å; L110-V346 HydrophobicContact CD2-CG2 4.43Å; L110-L355 HydrophobicContact CD2-CD1 4.12Å
111	L	98.3	Very high	97.5	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-41.6	172.4	-62.7	-176.7	0	0	0	111	F107 T108 R114 L115 I219 L229 F230 F261 N264 L265 L268	F107-L111 PolarHBondContact O-N 3.02Å; T108-L111 WeakPolarHBondContact O-CB 3.46Å; T108-L111 PolarHBondContact O-N 2.94Å; T108-L111 VanDerWaalsContact O-N 3.17Å; L111-R114 PolarHBondContact O-N 3.34Å; L111-L115 WeakPolarHBondContact O-CG 3.38Å; L111-L115 PolarHBondContact O-N 3.49Å; L111-I219 HydrophobicContact CB-CD1 4.37Å; L111-L229 HydrophobicContact CB-CD1 4.35Å; L111-L229 HydrophobicContact CD2-CD1 4.22Å; L111-F230 HydrophobicContact CD2-CE2 4.14Å; L111-F230 HydrophobicContact CD2-CZ 4.19Å; L111-F261 HydrophobicContact CD1-CD2 4.35Å; L111-F261 HydrophobicContact CD1-CE2 3.78Å; L111-F261 HydrophobicContact CD1-CZ 4.32Å; L111-N264 HydrophobicContact CD1-CB 4.31Å; L111-L265 HydrophobicContact CD1-CD2 3.93Å; L111-L265 HydrophobicContact CD1-CG 4.18Å; L111-L268 HydrophobicContact CD2-CB 4.01Å; L111-L268 HydrophobicContact CD2-CD2 3.94Å; L111-L268 HydrophobicContact CD2-CG 4.44Å; L111-L268 HydrophobicContact CG-CD2 4.2Å
112	V	98.5	Very high	97.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.8	-44.7	174.5	177.5	0	0	0	0	111.5	T108 S109 L110 R114 L115 L116 L121 L123 V148 L152 L215 I219	T108-V112 PolarHBondContact O-N 2.98Å; T108-V112 VanDerWaalsContact O-N 3.09Å; S109-V112 PolarHBondContact O-N 3.35Å; L110-V112 VanDerWaalsContact C-N 3.3Å; L110-V112 PolarHBondContact O-N 3.4Å; V112-R114 PolarHBondContact O-N 3Å; V112-L115 WeakPolarHBondContact O-CB 3.41Å; V112-L115 PolarHBondContact O-N 3.22Å; V112-L115 VanDerWaalsContact O-N 3.07Å; V112-L116 HydrophobicContact CG1-CD1 4.14Å; V112-L116 PolarHBondContact O-N 3.32Å; V112-L121 HydrophobicContact CG1-CD1 4.06Å; V112-L121 HydrophobicContact CG1-CD2 3.86Å; V112-L123 HydrophobicContact CG1-CD2 4.17Å; V112-V148 HydrophobicContact CG1-CG1 3.86Å; V112-V148 HydrophobicContact CG2-CG1 4.31Å; V112-L152 HydrophobicContact CB-CD1 4.1Å; V112-L152 HydrophobicContact CG1-CD1 3.83Å; V112-L152 HydrophobicContact CG2-CD1 4.15Å; V112-L215 HydrophobicContact CG2-CD1 4.06Å; V112-L215 HydrophobicContact CG2-CD2 4.12Å; V112-L215 HydrophobicContact CG2-CG 4.37Å; V112-I219 HydrophobicContact CG2-CD1 3.88Å; V112-I219 HydrophobicContact CG2-CG1 4.32Å
113	G	97.7	Very high	97.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-54.9	-39.6	174.6	0	0	0	0	0	112.4	S109 L110 L116 D117	S109-G113 PolarHBondContact O-N 3.1Å; L110-G113 PolarHBondContact O-N 2.69Å; G113-L116 WeakPolarHBondContact O-CB 3.19Å; G113-L116 PolarHBondContact O-N 3.45Å; G113-D117 PolarHBondContact O-N 3.34Å
114	R	96.3	Very high	97.6	Very high	33 Å²	33	27.6 Å²	27.6	13%	0.125	12%	0.124	C	C	.	.	H	α-helix	trans	-69.6	-37.8	176.4	-166.8	170.8	180	82.8	3.7	112.7	L110 L111 V112 L116 D117 Q118 L229 I345	L110-R114 WeakPolarHBondContact O-CB 3.47Å; L110-R114 PolarHBondContact O-N 2.93Å; L111-R114 PolarHBondContact O-N 3.34Å; V112-R114 PolarHBondContact O-N 3Å; R114-L116 VanDerWaalsContact C-N 3.3Å; R114-L116 PolarHBondContact O-N 2.94Å; R114-D117 PolarHBondContact O-N 2.78Å; R114-Q118 WeakPolarHBondContact O-CB 3.3Å; R114-Q118 VanDerWaalsContact O-CG 3.27Å; R114-Q118 WeakPolarHBondContact O-CG 3.33Å; R114-Q118 PolarHBondContact O-N 3.47Å; R114-Q118 VanDerWaalsContact O-N 3.14Å; R114-L229 HydrophobicContact CB-CD2 3.86Å; R114-L229 HydrophobicContact CG-CD2 3.85Å; R114-L229 PolarHBondContact NE-O 2.94Å; R114-I345 PolarHBondContact NH1-O 3.09Å; R114-I345 VanDerWaalsContact NH1-O 3.15Å
115	L	97.5	Very high	97.6	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-37.5	171.6	-68.1	175.2	0	0	0	112	L111 V112 Q118 R119 K120 L121 I219 I222 L229	L111-L115 WeakPolarHBondContact O-CG 3.38Å; L111-L115 PolarHBondContact O-N 3.49Å; V112-L115 WeakPolarHBondContact O-CB 3.41Å; V112-L115 PolarHBondContact O-N 3.22Å; V112-L115 VanDerWaalsContact O-N 3.07Å; L115-Q118 CarbonylContact O-C 3.57Å; L115-Q118 PolarHBondContact O-N 3.48Å; L115-R119 PolarHBondContact O-N 3.05Å; L115-K120 HydrophobicContact CB-CB 4.45Å; L115-K120 HydrophobicContact CD2-CB 4.06Å; L115-K120 HydrophobicContact CD2-CD 4.1Å; L115-K120 PolarHBondContact O-N 3.01Å; L115-L121 HydrophobicContact CB-CB 3.71Å; L115-L121 HydrophobicContact CB-CD1 4.42Å; L115-L121 HydrophobicContact CD1-CB 4.43Å; L115-L121 HydrophobicContact CD1-CD1 3.93Å; L115-I219 HydrophobicContact CD1-CG1 4.14Å; L115-I219 HydrophobicContact CD1-CG2 4.4Å; L115-I222 HydrophobicContact CD1-CB 4.33Å; L115-I222 HydrophobicContact CD1-CD1 4.17Å; L115-I222 HydrophobicContact CD1-CG2 3.99Å; L115-I222 HydrophobicContact CD2-CG2 3.78Å; L115-I222 HydrophobicContact CG-CG2 4.44Å; L115-L229 HydrophobicContact CD2-CD1 4.36Å; L115-L229 HydrophobicContact CD2-CD2 3.49Å; L115-L229 VanDerWaalsContact CD2-CD2 3.49Å; L115-L229 HydrophobicContact CD2-CG 3.78Å; L115-L229 HydrophobicContact CG-CD2 3.75Å; L115-L229 HydrophobicContact CG-CG 4.34Å
116	L	97	Very high	97.6	Very high	30 Å²	30	31.9 Å²	31.9	16%	0.157	15%	0.145	C	C	.	.	H	α-helix	trans	-64	-48.3	175.6	-76.3	162.2	0	0	0	111.6	V112 G113 R114 Q118 R119 L121 L123 L354	V112-L116 HydrophobicContact CG1-CD1 4.14Å; V112-L116 PolarHBondContact O-N 3.32Å; G113-L116 WeakPolarHBondContact O-CB 3.19Å; G113-L116 PolarHBondContact O-N 3.45Å; R114-L116 VanDerWaalsContact C-N 3.3Å; R114-L116 PolarHBondContact O-N 2.94Å; L116-Q118 PolarHBondContact O-N 2.9Å; L116-R119 WeakPolarHBondContact O-CA 3.49Å; L116-R119 PolarHBondContact O-N 3.38Å; L116-L121 HydrophobicContact CD1-CD2 4.49Å; L116-L121 HydrophobicContact CD2-CD2 3.74Å; L116-L121 WeakPolarHBondContact CD2-O 3.44Å; L116-L121 HydrophobicContact CG-CD2 3.85Å; L116-L123 HydrophobicContact CD1-CD1 3.89Å; L116-L123 HydrophobicContact CD1-CD2 4.04Å; L116-L123 HydrophobicContact CD1-CG 3.86Å; L116-L123 HydrophobicContact CD2-CD1 4.31Å; L116-L123 HydrophobicContact CD2-CG 3.86Å; L116-L123 HydrophobicContact CG-CG 4.4Å; L116-L354 HydrophobicContact CD1-CD1 4.22Å
117	D	95.6	Very high	97.6	Very high	30 Å²	30	31.9 Å²	31.9	16%	0.16	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-32.1	178.5	-78.6	-27	0	0	0	112.9	G113 R114 R119 V346 K347 T350	G113-D117 PolarHBondContact O-N 3.34Å; R114-D117 PolarHBondContact O-N 2.78Å; D117-R119 VanDerWaalsContact C-N 3.31Å; D117-V346 WeakPolarHBondContact OD2-CA 3.44Å; D117-V346 WeakPolarHBondContact OD2-CB 3.22Å; D117-K347 VanDerWaalsContact OD1-CD 3.29Å; D117-K347 WeakPolarHBondContact OD1-CD 3.5Å; D117-K347 WeakPolarHBondContact OD1-CG 3.26Å; D117-K347 IonicContact OD1-NZ 3.95Å; D117-K347 PolarHBondContact OD2-N 3.2Å; D117-T350 PolarHBondContact OD1-OG1 2.73Å
118	Q	95.5	Very high	97.5	Very high	55 Å²	55	34.8 Å²	34.8	26%	0.257	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.8	175.5	-66.6	175.8	-0.5	0	0	113.7	R114 L115 L116 K120 L229	R114-Q118 WeakPolarHBondContact O-CB 3.3Å; R114-Q118 VanDerWaalsContact O-CG 3.27Å; R114-Q118 WeakPolarHBondContact O-CG 3.33Å; R114-Q118 PolarHBondContact O-N 3.47Å; R114-Q118 VanDerWaalsContact O-N 3.14Å; L115-Q118 CarbonylContact O-C 3.57Å; L115-Q118 PolarHBondContact O-N 3.48Å; L116-Q118 PolarHBondContact O-N 2.9Å; Q118-K120 HydrophobicContact CB-CD 4.06Å; Q118-K120 HydrophobicContact CB-CG 3.94Å; Q118-K120 PolarHBondContact O-N 3.09Å; Q118-K120 VanDerWaalsContact OE1-CE 3.26Å; Q118-L229 PolarHBondContact NE2-O 3.12Å
119	R	96.4	Very high	97.5	Very high	229 Å²	229	37.9 Å²	37.9	86%	0.864	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	28.8	-176.1	-54.2	-178.9	178.2	-171.5	-1.3	113.6	L115 L116 D117	L115-R119 PolarHBondContact O-N 3.05Å; L116-R119 WeakPolarHBondContact O-CA 3.49Å; L116-R119 PolarHBondContact O-N 3.38Å; D117-R119 VanDerWaalsContact C-N 3.31Å
120	K	97.3	Very high	97.5	Very high	32 Å²	32	38.8 Å²	38.8	14%	0.139	18%	0.181	C	C	.	.			trans	-89.8	-20.1	178.8	-67	-178.3	-177.4	173.2	0	112.5	L115 Q118 I222 K226 G227 S228	L115-K120 HydrophobicContact CB-CB 4.45Å; L115-K120 HydrophobicContact CD2-CB 4.06Å; L115-K120 HydrophobicContact CD2-CD 4.1Å; L115-K120 PolarHBondContact O-N 3.01Å; Q118-K120 HydrophobicContact CB-CD 4.06Å; Q118-K120 HydrophobicContact CB-CG 3.94Å; Q118-K120 PolarHBondContact O-N 3.09Å; Q118-K120 VanDerWaalsContact OE1-CE 3.26Å; K120-I222 HydrophobicContact CB-CG2 3.99Å; K120-K226 HydrophobicContact CB-CB 4.23Å; K120-K226 HydrophobicContact CB-CD 3.93Å; K120-K226 HydrophobicContact CD-CB 3.99Å; K120-K226 WeakPolarHBondContact CE-O 3.39Å; K120-K226 HydrophobicContact CG-CB 3.96Å; K120-K226 HydrophobicContact CG-CD 4.32Å; K120-K226 PolarHBondContact NZ-O 2.92Å; K120-K226 WeakPolarHBondContact O-CD 3.15Å; K120-K226 WeakPolarHBondContact O-CE 3.46Å; K120-K226 PolarHBondContact O-NZ 2.89Å; K120-G227 PolarHBondContact NZ-O 3.06Å; K120-S228 PolarHBondContact NZ-O 3.37Å
121	L	97.6	Very high	97.4	Very high	11 Å²	11	38.9 Å²	38.9	6%	0.058	18%	0.181	C	C	.	.			trans	-131	139.3	-177.2	177.7	148.4	0	0	0	109.7	V112 L115 L116 L123 V148 I222	V112-L121 HydrophobicContact CG1-CD1 4.06Å; V112-L121 HydrophobicContact CG1-CD2 3.86Å; L115-L121 HydrophobicContact CB-CB 3.71Å; L115-L121 HydrophobicContact CB-CD1 4.42Å; L115-L121 HydrophobicContact CD1-CB 4.43Å; L115-L121 HydrophobicContact CD1-CD1 3.93Å; L116-L121 HydrophobicContact CD1-CD2 4.49Å; L116-L121 HydrophobicContact CD2-CD2 3.74Å; L116-L121 WeakPolarHBondContact CD2-O 3.44Å; L116-L121 HydrophobicContact CG-CD2 3.85Å; L121-L123 HydrophobicContact CD2-CD2 4.07Å; L121-L123 HydrophobicContact CD2-CG 4.26Å; L121-V148 HydrophobicContact CD1-CB 4.38Å; L121-V148 HydrophobicContact CD1-CG1 4.13Å; L121-V148 HydrophobicContact CD1-CG2 3.86Å; L121-V148 HydrophobicContact CD2-CB 4.46Å; L121-V148 HydrophobicContact CD2-CG1 4.31Å; L121-V148 HydrophobicContact CG-CG2 4.4Å; L121-I222 HydrophobicContact CB-CD1 4.2Å; L121-I222 HydrophobicContact CD1-CD1 3.51Å; L121-I222 HydrophobicContact CG-CD1 4.16Å
122	D	97.7	Very high	97.3	Very high	81 Å²	81	42.6 Å²	42.6	43%	0.433	21%	0.206	S	C	.	.			trans	-106.4	130.4	162.8	-177	-20	0	0	0	107.8	D124 E125 Y130	D122-D124 VanDerWaalsContact C-N 3.27Å; D122-D124 PolarHBondContact O-N 2.86Å; D122-D124 PolarHBondContact OD1-N 3.17Å; D122-E125 HydrophobicContact CB-CB 3.79Å; D122-Y130 PolarHBondContact N-OH 3.21Å
123	L	97.7	Very high	97.1	Very high	6 Å²	6	47 Å²	47	3%	0.031	23%	0.226	C	C	.	.	S	Bend	trans	-66.6	-29.6	-177.3	-83	174.2	0	0	0	112.9	V112 L116 L121 T147 V148 R149 L152 L354 L371	V112-L123 HydrophobicContact CG1-CD2 4.17Å; L116-L123 HydrophobicContact CD1-CD1 3.89Å; L116-L123 HydrophobicContact CD1-CD2 4.04Å; L116-L123 HydrophobicContact CD1-CG 3.86Å; L116-L123 HydrophobicContact CD2-CD1 4.31Å; L116-L123 HydrophobicContact CD2-CG 3.86Å; L116-L123 HydrophobicContact CG-CG 4.4Å; L121-L123 HydrophobicContact CD2-CD2 4.07Å; L121-L123 HydrophobicContact CD2-CG 4.26Å; L123-T147 VanDerWaalsContact O-CB 3.3Å; L123-T147 WeakPolarHBondContact O-CB 3.45Å; L123-V148 HydrophobicContact CD2-CB 4.41Å; L123-V148 HydrophobicContact CD2-CG1 3.99Å; L123-V148 PolarHBondContact O-N 2.6Å; L123-R149 HydrophobicContact CB-CB 4.3Å; L123-R149 WeakPolarHBondContact O-CB 3.33Å; L123-R149 PolarHBondContact O-N 3.32Å; L123-L152 HydrophobicContact CD2-CD1 4.31Å; L123-L354 HydrophobicContact CD1-CD2 4.37Å; L123-L371 HydrophobicContact CD1-CD1 3.78Å; L123-L371 HydrophobicContact CD2-CD1 4.06Å
124	D	97.7	Very high	97.1	Very high	71 Å²	71	47.1 Å²	47.1	38%	0.38	23%	0.227	S	C	.	.	S	Bend	trans	-108.2	-2.7	-169.8	-63.9	-54	0	0	0	112.6	D122 K145 T147 R149	D122-D124 VanDerWaalsContact C-N 3.27Å; D122-D124 PolarHBondContact O-N 2.86Å; D122-D124 PolarHBondContact OD1-N 3.17Å; D124-K145 WeakPolarHBondContact O-CE 3.23Å; D124-K145 PolarHBondContact O-NZ 3.26Å; D124-T147 VanDerWaalsContact O-CG2 3.31Å; D124-T147 WeakPolarHBondContact O-CG2 3.17Å; D124-R149 WeakPolarHBondContact OD1-CD 3.43Å; D124-R149 IonicContact OD1-CZ 3.91Å; D124-R149 IonicContact OD1-NE 2.77Å; D124-R149 PolarHBondContact OD1-NE 3.21Å; D124-R149 IonicContact OD1-NH2 3.86Å; D124-R149 IonicContact OD2-CZ 2.73Å; D124-R149 IonicContact OD2-NE 3.74Å; D124-R149 PolarHBondContact OD2-NE 3.38Å; D124-R149 IonicContact OD2-NH2 2.82Å; D124-R149 PolarHBondContact OD2-NH2 3.31Å
125	E	97.7	Very high	97.1	Very high	73 Å²	73	47.1 Å²	47.1	34%	0.341	23%	0.231	S	C	.	.	S	Bend	trans	-67.5	150.8	169.4	-173.5	55.1	-124.8	0	0	111.2	D122 I127 S129 Y130	D122-E125 HydrophobicContact CB-CB 3.79Å; E125-I127 PolarHBondContact O-N 3.39Å; E125-S129 WeakPolarHBondContact CG-OG 3.26Å; E125-Y130 HydrophobicContact CB-CE2 4.18Å; E125-Y130 HydrophobicContact CG-CE2 4.16Å
126	D	98.2	Very high	97.1	Very high	17 Å²	17	52.5 Å²	52.5	9%	0.091	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-64.9	133.7	175.5	-164.2	-48.5	0	0	0	110.1	R128 S129 Y143 K145	D126-R128 PolarHBondContact O-N 3.28Å; D126-R128 VanDerWaalsContact O-N 3.15Å; D126-R128 WeakPolarHBondContact OD1-CB 3.3Å; D126-R128 PolarHBondContact OD1-N 2.99Å; D126-S129 VanDerWaalsContact O-CB 3.29Å; D126-S129 WeakPolarHBondContact O-CB 3.35Å; D126-S129 PolarHBondContact O-N 3.47Å; D126-S129 PolarHBondContact O-OG 3.48Å; D126-Y143 VanDerWaalsContact CG-OH 3.27Å; D126-Y143 PolarHBondContact OD1-OH 3.49Å; D126-Y143 WeakPolarHBondContact OD2-CE1 3.48Å; D126-Y143 PolarHBondContact OD2-OH 3.38Å; D126-K145 HydrophobicContact CB-CG 4.01Å; D126-K145 VanDerWaalsContact N-CE 3.25Å
127	I	98.3	Very high	97.1	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-57.8	-29.2	176.2	61.9	166.9	0	0	0	112.6	E125 S129 Y130 L131 F134 I146 V148 L151 L214 V218	E125-I127 PolarHBondContact O-N 3.39Å; I127-S129 PolarHBondContact O-N 2.83Å; I127-Y130 PolarHBondContact O-N 2.87Å; I127-L131 PolarHBondContact O-N 3.48Å; I127-F134 HydrophobicContact CD1-CD1 4.03Å; I127-F134 HydrophobicContact CD1-CE1 4.35Å; I127-F134 HydrophobicContact CD1-CG 4.49Å; I127-I146 HydrophobicContact CD1-CB 3.94Å; I127-I146 HydrophobicContact CD1-CG2 3.71Å; I127-I146 HydrophobicContact CG1-CB 4.04Å; I127-I146 HydrophobicContact CG1-CG2 4.12Å; I127-I146 HydrophobicContact CG2-CG2 4.21Å; I127-I146 WeakPolarHBondContact CG2-O 3.49Å; I127-I146 PolarHBondContact N-O 3.49Å; I127-V148 HydrophobicContact CG2-CG2 4.22Å; I127-L151 HydrophobicContact CG2-CD1 3.96Å; I127-L214 HydrophobicContact CD1-CD1 4.28Å; I127-L214 HydrophobicContact CD1-CD2 3.63Å; I127-L214 HydrophobicContact CD1-CG 4.09Å; I127-V218 HydrophobicContact CB-CG2 4.01Å; I127-V218 HydrophobicContact CG2-CG2 4.18Å
128	R	98	Very high	96.9	Very high	61 Å²	61	55.7 Å²	55.7	23%	0.23	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-67.8	-17.9	178.3	-78.2	176	51.6	96.9	-5.1	112.9	D126 Y130 L131 P132 F134 E136 Y143	D126-R128 PolarHBondContact O-N 3.28Å; D126-R128 VanDerWaalsContact O-N 3.15Å; D126-R128 WeakPolarHBondContact OD1-CB 3.3Å; D126-R128 PolarHBondContact OD1-N 2.99Å; R128-Y130 PolarHBondContact O-N 3Å; R128-L131 CarbonylContact O-C 3.42Å; R128-P132 PolarHBondContact NH1-O 2.89Å; R128-P132 VanDerWaalsContact O-CA 3.3Å; R128-P132 WeakPolarHBondContact O-CA 3.43Å; R128-F134 WeakPolarHBondContact CD-O 3.26Å; R128-F134 PolarHBondContact NH1-O 3.08Å; R128-E136 IonicContact CZ-OE1 3.68Å; R128-E136 IonicContact NE-OE1 3.71Å; R128-E136 IonicContact NH2-OE1 2.6Å; R128-E136 PolarHBondContact NH2-OE1 3.35Å; R128-Y143 WeakPolarHBondContact CD-OH 3.48Å
129	S	97.8	Very high	96.6	Very high	65 Å²	65	54.1 Å²	54.1	46%	0.455	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-64.4	-27.4	168.5	73.2	0	0	0	0	112.3	E125 D126 I127	E125-S129 WeakPolarHBondContact CG-OG 3.26Å; D126-S129 VanDerWaalsContact O-CB 3.29Å; D126-S129 WeakPolarHBondContact O-CB 3.35Å; D126-S129 PolarHBondContact O-N 3.47Å; D126-S129 PolarHBondContact O-OG 3.48Å; I127-S129 PolarHBondContact O-N 2.83Å
130	Y	97.4	Very high	96.1	Very high	19 Å²	19	50 Å²	50	8%	0.075	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-35.9	177	-52.9	-66.6	0	0	0	112.3	D122 E125 I127 R128 V218 K221 I222	D122-Y130 PolarHBondContact N-OH 3.21Å; E125-Y130 HydrophobicContact CB-CE2 4.18Å; E125-Y130 HydrophobicContact CG-CE2 4.16Å; I127-Y130 PolarHBondContact O-N 2.87Å; R128-Y130 PolarHBondContact O-N 3Å; Y130-V218 HydrophobicContact CD2-CG1 4.18Å; Y130-V218 HydrophobicContact CG-CG1 4.47Å; Y130-K221 VanDerWaalsContact O-CB 3.25Å; Y130-K221 WeakPolarHBondContact O-CB 3.28Å; Y130-I222 HydrophobicContact CD1-CD1 3.87Å; Y130-I222 HydrophobicContact CD1-CG1 3.48Å; Y130-I222 VanDerWaalsContact CD1-CG1 3.48Å; Y130-I222 HydrophobicContact CD2-CD1 4.09Å; Y130-I222 HydrophobicContact CD2-CG1 4.43Å; Y130-I222 HydrophobicContact CE1-CD1 4.16Å; Y130-I222 HydrophobicContact CE1-CG1 4.1Å; Y130-I222 HydrophobicContact CE2-CD1 4.4Å; Y130-I222 HydrophobicContact CG-CD1 3.83Å; Y130-I222 HydrophobicContact CG-CG1 3.67Å
131	L	97.3	Very high	95.6	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.297	C	S	.	.			trans	-129.6	70.3	-173.9	-173.9	69.8	0	0	0	110.2	I127 R128 E133 F134 L186 L214 A217 V218 K221	I127-L131 PolarHBondContact O-N 3.48Å; R128-L131 CarbonylContact O-C 3.42Å; L131-E133 WeakPolarHBondContact CD1-OE2 3.47Å; L131-E133 PolarHBondContact O-N 2.8Å; L131-E133 VanDerWaalsContact O-N 3.12Å; L131-F134 HydrophobicContact CD2-CB 3.9Å; L131-F134 HydrophobicContact CG-CB 4.07Å; L131-F134 PolarHBondContact O-N 3.24Å; L131-F134 VanDerWaalsContact O-N 3.15Å; L131-L186 HydrophobicContact CD1-CD1 4.21Å; L131-L186 HydrophobicContact CD2-CD1 4.28Å; L131-L214 HydrophobicContact CD2-CD1 3.8Å; L131-A217 HydrophobicContact CD2-CB 3.88Å; L131-V218 HydrophobicContact CB-CG2 4.34Å; L131-V218 HydrophobicContact CD2-CG2 4.07Å; L131-K221 HydrophobicContact CD1-CD 4.42Å; L131-K221 HydrophobicContact CD1-CG 3.49Å; L131-K221 VanDerWaalsContact CD1-CG 3.49Å
132	P	96.8	Very high	95.2	Very high	79 Å²	79	61.3 Å²	61.3	51%	0.513	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.7	-176.4	25.6	-35.5	0	0	0	113.6	R128 F134	R128-P132 PolarHBondContact NH1-O 2.89Å; R128-P132 VanDerWaalsContact O-CA 3.3Å; R128-P132 WeakPolarHBondContact O-CA 3.43Å; P132-F134 VanDerWaalsContact C-N 3.31Å; P132-F134 PolarHBondContact O-N 2.95Å
133	E	94.4	Very high	95.1	Very high	93 Å²	93	61.9 Å²	61.9	44%	0.435	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-17	178.5	-50.7	92.1	155.2	0	0	113.5	L131 L186 K221	L131-E133 WeakPolarHBondContact CD1-OE2 3.47Å; L131-E133 PolarHBondContact O-N 2.8Å; L131-E133 VanDerWaalsContact O-N 3.12Å; E133-L186 HydrophobicContact CB-CD2 4.14Å; E133-K221 VanDerWaalsContact OE1-CE 3.23Å; E133-K221 WeakPolarHBondContact OE1-CE 3.28Å; E133-K221 IonicContact OE1-NZ 2.74Å; E133-K221 PolarHBondContact OE1-NZ 2.81Å
134	F	97	Very high	95	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.009	32%	0.317	C	S	.	.	S	Bend	trans	-74.7	128	175.7	-172.7	-95	0	0	0	110	I127 R128 L131 P132 K137 I146 I158 F192 K193 L214	I127-F134 HydrophobicContact CD1-CD1 4.03Å; I127-F134 HydrophobicContact CD1-CE1 4.35Å; I127-F134 HydrophobicContact CD1-CG 4.49Å; R128-F134 WeakPolarHBondContact CD-O 3.26Å; R128-F134 PolarHBondContact NH1-O 3.08Å; L131-F134 HydrophobicContact CD2-CB 3.9Å; L131-F134 HydrophobicContact CG-CB 4.07Å; L131-F134 PolarHBondContact O-N 3.24Å; L131-F134 VanDerWaalsContact O-N 3.15Å; P132-F134 VanDerWaalsContact C-N 3.31Å; P132-F134 PolarHBondContact O-N 2.95Å; F134-K137 HydrophobicContact CE1-CG 4.48Å; F134-I146 HydrophobicContact CE1-CD1 4.28Å; F134-I158 HydrophobicContact CZ-CD1 4.32Å; F134-F192 HydrophobicContact CE2-CE2 4.34Å; F134-K193 HydrophobicContact CD2-CB 4.18Å; F134-K193 HydrophobicContact CE2-CB 3.62Å; F134-K193 HydrophobicContact CZ-CB 4.28Å; F134-L214 HydrophobicContact CD1-CD2 4.47Å; F134-L214 HydrophobicContact CD2-CD1 3.35Å; F134-L214 HydrophobicContact CD2-CD2 4.23Å; F134-L214 HydrophobicContact CD2-CG 4.44Å; F134-L214 HydrophobicContact CE1-CD2 3.95Å; F134-L214 HydrophobicContact CE2-CD1 3.51Å; F134-L214 HydrophobicContact CE2-CD2 3.69Å; F134-L214 HydrophobicContact CE2-CG 4.21Å; F134-L214 HydrophobicContact CG-CD1 3.93Å; F134-L214 HydrophobicContact CZ-CD1 4.21Å; F134-L214 HydrophobicContact CZ-CD2 3.53Å
135	P	97.1	Very high	94.9	Very high	33 Å²	33	62.9 Å²	62.9	21%	0.214	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-61.6	149	-169.7	26	-36.1	0	0	0	113.6	K193	P135-K193 HydrophobicContact CG-CB 4.12Å; P135-K193 HydrophobicContact CG-CG 4.35Å; P135-K193 WeakPolarHBondContact CG-O 3.31Å
136	E	97	Very high	95	Very high	113 Å²	113	59.6 Å²	59.6	53%	0.528	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-60.4	143.5	171.4	-62.9	-170.9	170.7	0	0	110.6	R128 Y143	R128-E136 IonicContact CZ-OE1 3.68Å; R128-E136 IonicContact NE-OE1 3.71Å; R128-E136 IonicContact NH2-OE1 2.6Å; R128-E136 PolarHBondContact NH2-OE1 3.35Å; E136-Y143 HydrophobicContact CB-CD2 4.31Å; E136-Y143 HydrophobicContact CB-CE2 4.02Å; E136-Y143 HydrophobicContact CG-CD2 4.49Å; E136-Y143 HydrophobicContact CG-CE2 3.95Å
137	K	96.9	Very high	95	Very high	15 Å²	15	59.6 Å²	59.6	7%	0.065	30%	0.304	C	S	.	.			trans	-110.3	125.7	175.7	-62.9	-58.7	-168.7	175.6	0	108.2	F134 A144 I146 K193 D195 L197	F134-K137 HydrophobicContact CE1-CG 4.48Å; K137-A144 HydrophobicContact CB-CB 3.99Å; K137-A144 PolarHBondContact O-N 2.89Å; K137-I146 HydrophobicContact CG-CD1 3.94Å; K137-K193 PolarHBondContact NZ-O 3.09Å; K137-D195 PolarHBondContact NZ-O 3.26Å; K137-L197 HydrophobicContact CB-CD1 3.78Å; K137-L197 HydrophobicContact CB-CG 4.06Å; K137-L197 HydrophobicContact CD-CD2 4.21Å; K137-L197 HydrophobicContact CD-CG 4.25Å; K137-L197 HydrophobicContact CG-CD1 4.14Å; K137-L197 HydrophobicContact CG-CD2 4.11Å; K137-L197 HydrophobicContact CG-CG 4.08Å
138	I	92	Very high	95	Very high	112 Å²	112	59.6 Å²	59.6	57%	0.574	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	127	175.5	-58.1	176.1	0	0	0	107.1	T142	I138-T142 WeakPolarHBondContact CA-O 3.39Å
139	V	88.3	Confident	95	Very high	23 Å²	23	59.9 Å²	59.9	14%	0.139	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124.8	173.8	179.9	0	0	0	0	106.5	E141 T142 A144 L197 L200	V139-E141 VanDerWaalsContact C-N 3.32Å; V139-E141 PolarHBondContact O-N 3.07Å; V139-T142 PolarHBondContact N-O 2.89Å; V139-T142 PolarHBondContact O-N 2.89Å; V139-A144 HydrophobicContact CG2-CB 4.19Å; V139-L197 HydrophobicContact CG2-CB 3.94Å; V139-L197 HydrophobicContact CG2-CD1 4.09Å; V139-L197 HydrophobicContact CG2-CG 4.32Å; V139-L200 HydrophobicContact CB-CD2 3.66Å; V139-L200 HydrophobicContact CB-CG 4.21Å; V139-L200 HydrophobicContact CG1-CD2 3.99Å; V139-L200 HydrophobicContact CG1-CG 3.96Å; V139-L200 HydrophobicContact CG2-CD2 4.22Å
140	N	86.6	Confident	95	Very high	141 Å²	141	57 Å²	57	75%	0.754	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	51.8	-176.1	-56.1	-24	0	0	0	112.3	T142	N140-T142 PolarHBondContact O-N 2.6Å; N140-T142 PolarHBondContact O-OG1 3Å
141	E	87	Confident	95	Very high	194 Å²	194	56.1 Å²	56.1	91%	0.907	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	6.2	179.9	-54.5	-178.2	166.1	0	0	115.5	V139	V139-E141 VanDerWaalsContact C-N 3.32Å; V139-E141 PolarHBondContact O-N 3.07Å
142	T	88.1	Confident	95.1	Very high	87 Å²	87	56 Å²	56	53%	0.534	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.4	-178.9	-55.2	0	0	0	0	110.5	I138 V139 N140 A144	I138-T142 WeakPolarHBondContact CA-O 3.39Å; V139-T142 PolarHBondContact N-O 2.89Å; V139-T142 PolarHBondContact O-N 2.89Å; N140-T142 PolarHBondContact O-N 2.6Å; N140-T142 PolarHBondContact O-OG1 3Å; T142-A144 PolarHBondContact O-N 2.81Å
143	Y	94.7	Very high	95	Very high	93 Å²	93	52.6 Å²	52.6	37%	0.365	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	123.1	172.1	177.4	-98.6	0	0	0	110.7	D126 R128 E136 K145	D126-Y143 VanDerWaalsContact CG-OH 3.27Å; D126-Y143 PolarHBondContact OD1-OH 3.49Å; D126-Y143 WeakPolarHBondContact OD2-CE1 3.48Å; D126-Y143 PolarHBondContact OD2-OH 3.38Å; R128-Y143 WeakPolarHBondContact CD-OH 3.48Å; E136-Y143 HydrophobicContact CB-CD2 4.31Å; E136-Y143 HydrophobicContact CB-CE2 4.02Å; E136-Y143 HydrophobicContact CG-CD2 4.49Å; E136-Y143 HydrophobicContact CG-CE2 3.95Å; Y143-K145 HydrophobicContact CE1-CB 4.21Å
144	A	96.1	Very high	95.1	Very high	5 Å²	5	48.3 Å²	48.3	4%	0.041	24%	0.238	C	C	.	.			trans	-95.9	98.4	-178.4	0	0	0	0	0	110.4	K137 V139 T142 I146 L197 L200 P201	K137-A144 HydrophobicContact CB-CB 3.99Å; K137-A144 PolarHBondContact O-N 2.89Å; V139-A144 HydrophobicContact CG2-CB 4.19Å; T142-A144 PolarHBondContact O-N 2.81Å; A144-I146 PolarHBondContact O-N 3.18Å; A144-I146 VanDerWaalsContact O-N 3.15Å; A144-L197 HydrophobicContact CB-CD1 3.64Å; A144-L200 HydrophobicContact CB-CD2 4.11Å; A144-P201 HydrophobicContact CB-CG 4.08Å
145	K	96.9	Very high	95.1	Very high	94 Å²	94	48.5 Å²	48.5	41%	0.409	24%	0.239	S	C	.	.			trans	-65.5	107.5	176.3	-176.5	-177.3	-171	-175.4	0	110.8	D124 D126 Y143 T147 P201	D124-K145 WeakPolarHBondContact O-CE 3.23Å; D124-K145 PolarHBondContact O-NZ 3.26Å; D126-K145 HydrophobicContact CB-CG 4.01Å; D126-K145 VanDerWaalsContact N-CE 3.25Å; Y143-K145 HydrophobicContact CE1-CB 4.21Å; K145-T147 HydrophobicContact CD-CG2 4.2Å; K145-T147 HydrophobicContact CG-CG2 4.07Å; K145-P201 VanDerWaalsContact O-CB 3.26Å; K145-P201 WeakPolarHBondContact O-CB 3.38Å; K145-P201 WeakPolarHBondContact O-CG 3.48Å
146	I	98.2	Very high	95.1	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.015	23%	0.229	C	C	.	.			trans	-87.7	129.9	169.8	-62.4	173.9	0	0	0	108.1	I127 F134 K137 A144 L151 I158 L197 P201	I127-I146 HydrophobicContact CD1-CB 3.94Å; I127-I146 HydrophobicContact CD1-CG2 3.71Å; I127-I146 HydrophobicContact CG1-CB 4.04Å; I127-I146 HydrophobicContact CG1-CG2 4.12Å; I127-I146 HydrophobicContact CG2-CG2 4.21Å; I127-I146 WeakPolarHBondContact CG2-O 3.49Å; I127-I146 PolarHBondContact N-O 3.49Å; F134-I146 HydrophobicContact CE1-CD1 4.28Å; K137-I146 HydrophobicContact CG-CD1 3.94Å; A144-I146 PolarHBondContact O-N 3.18Å; A144-I146 VanDerWaalsContact O-N 3.15Å; I146-L151 HydrophobicContact CG2-CD1 4.45Å; I146-L151 HydrophobicContact CG2-CD2 3.84Å; I146-L151 HydrophobicContact CG2-CG 3.97Å; I146-I158 HydrophobicContact CD1-CD1 4Å; I146-I158 HydrophobicContact CD1-CG1 4.46Å; I146-L197 HydrophobicContact CD1-CD1 4.43Å; I146-L197 HydrophobicContact CD1-CD2 4.08Å; I146-P201 HydrophobicContact CG1-CG 3.94Å
147	T	98.4	Very high	95	Very high	18 Å²	18	41.5 Å²	41.5	11%	0.11	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-114.9	160.7	177.8	71.4	0	0	0	0	111.1	L123 D124 K145 R149 S150 L151	L123-T147 VanDerWaalsContact O-CB 3.3Å; L123-T147 WeakPolarHBondContact O-CB 3.45Å; D124-T147 VanDerWaalsContact O-CG2 3.31Å; D124-T147 WeakPolarHBondContact O-CG2 3.17Å; K145-T147 HydrophobicContact CD-CG2 4.2Å; K145-T147 HydrophobicContact CG-CG2 4.07Å; T147-R149 PolarHBondContact O-N 2.99Å; T147-S150 PolarHBondContact N-OG 3.38Å; T147-S150 PolarHBondContact O-N 3.45Å; T147-S150 VanDerWaalsContact O-N 3.1Å; T147-S150 PolarHBondContact O-OG 2.95Å; T147-S150 PolarHBondContact OG1-N 3.04Å; T147-S150 VanDerWaalsContact OG1-N 3.11Å; T147-L151 PolarHBondContact O-N 3.22Å; T147-L151 VanDerWaalsContact O-N 3.12Å
148	V	98.4	Very high	95.1	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-36.4	174	172.2	0	0	0	0	111	V112 L121 L123 I127 S150 L151 L152 L215 V218	V112-V148 HydrophobicContact CG1-CG1 3.86Å; V112-V148 HydrophobicContact CG2-CG1 4.31Å; L121-V148 HydrophobicContact CD1-CB 4.38Å; L121-V148 HydrophobicContact CD1-CG1 4.13Å; L121-V148 HydrophobicContact CD1-CG2 3.86Å; L121-V148 HydrophobicContact CD2-CB 4.46Å; L121-V148 HydrophobicContact CD2-CG1 4.31Å; L121-V148 HydrophobicContact CG-CG2 4.4Å; L123-V148 HydrophobicContact CD2-CB 4.41Å; L123-V148 HydrophobicContact CD2-CG1 3.99Å; L123-V148 PolarHBondContact O-N 2.6Å; I127-V148 HydrophobicContact CG2-CG2 4.22Å; V148-S150 VanDerWaalsContact C-N 3.34Å; V148-S150 PolarHBondContact O-N 3.07Å; V148-L151 PolarHBondContact O-N 3.31Å; V148-L152 HydrophobicContact CG1-CD1 3.82Å; V148-L152 HydrophobicContact CG1-CG 4.37Å; V148-L152 PolarHBondContact O-N 3.23Å; V148-L215 HydrophobicContact CG1-CD1 3.76Å; V148-L215 HydrophobicContact CG2-CD1 4.26Å; V148-V218 HydrophobicContact CG2-CG1 4.07Å
149	R	98.1	Very high	95.3	Very high	68 Å²	68	36.9 Å²	36.9	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-54.5	-50.9	172.3	-173.1	-179.4	-57.6	-76.6	0.5	111.2	L123 D124 T147 L151 L152 N153 L371	L123-R149 HydrophobicContact CB-CB 4.3Å; L123-R149 WeakPolarHBondContact O-CB 3.33Å; L123-R149 PolarHBondContact O-N 3.32Å; D124-R149 WeakPolarHBondContact OD1-CD 3.43Å; D124-R149 IonicContact OD1-CZ 3.91Å; D124-R149 IonicContact OD1-NE 2.77Å; D124-R149 PolarHBondContact OD1-NE 3.21Å; D124-R149 IonicContact OD1-NH2 3.86Å; D124-R149 IonicContact OD2-CZ 2.73Å; D124-R149 IonicContact OD2-NE 3.74Å; D124-R149 PolarHBondContact OD2-NE 3.38Å; D124-R149 IonicContact OD2-NH2 2.82Å; D124-R149 PolarHBondContact OD2-NH2 3.31Å; T147-R149 PolarHBondContact O-N 2.99Å; R149-L151 VanDerWaalsContact C-N 3.26Å; R149-L151 PolarHBondContact O-N 3.12Å; R149-L152 PolarHBondContact O-N 3.2Å; R149-N153 PolarHBondContact O-N 3.47Å; R149-N153 PolarHBondContact O-OD1 3.15Å; R149-L371 HydrophobicContact CG-CD2 3.97Å
150	S	97.6	Very high	95.6	Very high	4 Å²	4	38 Å²	38	3%	0.028	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-27.8	-178.8	77.6	0	0	0	0	113.4	T147 V148 N153 H154 T155 S156	T147-S150 PolarHBondContact N-OG 3.38Å; T147-S150 PolarHBondContact O-N 3.45Å; T147-S150 VanDerWaalsContact O-N 3.1Å; T147-S150 PolarHBondContact O-OG 2.95Å; T147-S150 PolarHBondContact OG1-N 3.04Å; T147-S150 VanDerWaalsContact OG1-N 3.11Å; V148-S150 VanDerWaalsContact C-N 3.34Å; V148-S150 PolarHBondContact O-N 3.07Å; S150-N153 WeakPolarHBondContact CA-OD1 3.48Å; S150-N153 PolarHBondContact O-OD1 3.03Å; S150-N153 VanDerWaalsContact O-OD1 3.12Å; S150-H154 PolarHBondContact O-N 3.31Å; S150-T155 CarbonylContact O-C 3.41Å; S150-T155 PolarHBondContact O-N 3.33Å; S150-S156 WeakPolarHBondContact O-CB 3.4Å; S150-S156 PolarHBondContact O-N 3.04Å; S150-S156 WeakPolarHBondContact OG-CB 3.26Å
151	L	98.4	Very high	96	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-74.1	-45.4	174.5	-65.4	175.8	0	0	0	111.4	I127 I146 T147 V148 R149 H154 I158 A211 L214 L215	I127-L151 HydrophobicContact CG2-CD1 3.96Å; I146-L151 HydrophobicContact CG2-CD1 4.45Å; I146-L151 HydrophobicContact CG2-CD2 3.84Å; I146-L151 HydrophobicContact CG2-CG 3.97Å; T147-L151 PolarHBondContact O-N 3.22Å; T147-L151 VanDerWaalsContact O-N 3.12Å; V148-L151 PolarHBondContact O-N 3.31Å; R149-L151 VanDerWaalsContact C-N 3.26Å; R149-L151 PolarHBondContact O-N 3.12Å; L151-H154 PolarHBondContact O-N 3.1Å; L151-I158 HydrophobicContact CD2-CG1 4.3Å; L151-A211 HydrophobicContact CB-CB 4.5Å; L151-A211 HydrophobicContact CD2-CB 3.88Å; L151-L214 HydrophobicContact CD1-CD2 4.4Å; L151-L214 HydrophobicContact CD1-CG 4.18Å; L151-L214 HydrophobicContact CD2-CD2 3.99Å; L151-L214 HydrophobicContact CD2-CG 4.45Å; L151-L215 HydrophobicContact CD1-CB 4.2Å; L151-L215 HydrophobicContact CD1-CD1 4.34Å
152	L	98.1	Very high	96.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70	-34.3	-176.6	-79.8	168.6	0	0	0	113.7	V112 L123 V148 R149 F212 L215 L371 G372	V112-L152 HydrophobicContact CB-CD1 4.1Å; V112-L152 HydrophobicContact CG1-CD1 3.83Å; V112-L152 HydrophobicContact CG2-CD1 4.15Å; L123-L152 HydrophobicContact CD2-CD1 4.31Å; V148-L152 HydrophobicContact CG1-CD1 3.82Å; V148-L152 HydrophobicContact CG1-CG 4.37Å; V148-L152 PolarHBondContact O-N 3.23Å; R149-L152 PolarHBondContact O-N 3.2Å; L152-F212 HydrophobicContact CD2-CE1 3.95Å; L152-F212 HydrophobicContact CD2-CZ 3.96Å; L152-L215 HydrophobicContact CD2-CD2 3.5Å; L152-L215 HydrophobicContact CG-CD2 3.78Å; L152-L371 HydrophobicContact CB-CB 3.85Å; L152-L371 HydrophobicContact CB-CD2 4.15Å; L152-L371 HydrophobicContact CD1-CB 3.98Å; L152-L371 HydrophobicContact CD1-CD1 4.49Å; L152-L371 HydrophobicContact CG-CB 4.42Å; L152-G372 PolarHBondContact O-N 2.71Å
153	N	96.1	Very high	96.4	Very high	6 Å²	6	27.7 Å²	27.7	3%	0.032	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	7.4	179.4	70.5	-0.6	0	0	0	114.1	R149 S150 T155 Y205 S359 L371	R149-N153 PolarHBondContact O-N 3.47Å; R149-N153 PolarHBondContact O-OD1 3.15Å; S150-N153 WeakPolarHBondContact CA-OD1 3.48Å; S150-N153 PolarHBondContact O-OD1 3.03Å; S150-N153 VanDerWaalsContact O-OD1 3.12Å; N153-T155 VanDerWaalsContact C-N 3.31Å; N153-T155 PolarHBondContact ND2-OG1 3.4Å; N153-T155 PolarHBondContact O-N 2.95Å; N153-T155 PolarHBondContact OD1-N 3.37Å; N153-T155 PolarHBondContact OD1-OG1 3.17Å; N153-Y205 WeakPolarHBondContact O-CD2 3.48Å; N153-S359 WeakPolarHBondContact CB-OG 3.31Å; N153-L371 HydrophobicContact CB-CD2 4.16Å
154	H	96.5	Very high	96.3	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.019	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	25.8	179.4	-59.6	-65.3	0	0	0	115.6	S150 L151 Y205 T206 Y207 S208 F212	S150-H154 PolarHBondContact O-N 3.31Å; L151-H154 PolarHBondContact O-N 3.1Å; H154-Y205 HydrophobicContact CB-CD2 3.85Å; H154-Y205 HydrophobicContact CB-CE2 3.54Å; H154-T206 WeakPolarHBondContact CB-O 3.46Å; H154-T206 CarbonylContact O-C 3.35Å; H154-T206 PolarHBondContact O-N 2.94Å; H154-Y207 AromaticContact CD2-CD2 3.48Å; H154-Y207 VanDerWaalsContact CD2-CD2 3.48Å; H154-Y207 WeakPolarHBondContact CD2-CD2 3.24Å; H154-Y207 AromaticContact CD2-CE2 3.77Å; H154-Y207 AromaticContact CE1-CD2 3.71Å; H154-Y207 AromaticContact CE1-CE2 3.71Å; H154-Y207 AromaticContact CG-CD2 3.96Å; H154-Y207 AromaticContact NE2-CD2 3.3Å; H154-Y207 VanDerWaalsContact NE2-CD2 3.3Å; H154-Y207 WeakPolarHBondContact NE2-CD2 3.18Å; H154-Y207 AromaticContact NE2-CE2 3.14Å; H154-Y207 WeakPolarHBondContact NE2-CE2 3.15Å; H154-Y207 AromaticContact NE2-CZ 3.97Å; H154-S208 PolarHBondContact CE1-O 2.81Å; H154-S208 PolarHBondContact ND1-N 3.22Å; H154-S208 VanDerWaalsContact ND1-N 3.2Å; H154-S208 PolarHBondContact ND1-O 2.58Å; H154-F212 AromaticContact CE1-CD2 3.78Å; H154-F212 AromaticContact CE1-CE2 3.36Å; H154-F212 WeakPolarHBondContact CE1-CE2 3.26Å; H154-F212 AromaticContact NE2-CE2 3.74Å
155	T	96.4	Very high	96.1	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.031	15%	0.154	C	C	.	.			trans	-103.3	7.5	175	70.3	0	0	0	0	114.8	S150 N153 G157 H199 P201 G202 E204 C360	S150-T155 CarbonylContact O-C 3.41Å; S150-T155 PolarHBondContact O-N 3.33Å; N153-T155 VanDerWaalsContact C-N 3.31Å; N153-T155 PolarHBondContact ND2-OG1 3.4Å; N153-T155 PolarHBondContact O-N 2.95Å; N153-T155 PolarHBondContact OD1-N 3.37Å; N153-T155 PolarHBondContact OD1-OG1 3.17Å; T155-G157 PolarHBondContact O-N 2.71Å; T155-H199 PolarHBondContact O-CE1 3.29Å; T155-P201 CarbonylContact O-C 3.43Å; T155-P201 VanDerWaalsContact O-CA 3.24Å; T155-P201 WeakPolarHBondContact O-CA 3.48Å; T155-G202 PolarHBondContact O-N 3.13Å; T155-G202 WeakPolarHBondContact OG1-CA 3.42Å; T155-E204 VanDerWaalsContact CA-O 3.24Å; T155-E204 WeakPolarHBondContact CA-O 3.35Å; T155-E204 VanDerWaalsContact CB-O 3.32Å; T155-E204 WeakPolarHBondContact CB-O 3.43Å; T155-E204 WeakPolarHBondContact CG2-O 3.44Å; T155-C360 HydrophobicContact CG2-CB 3.88Å
156	S	97	Very high	95.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-65	-15.4	-179.3	59.6	0	0	0	0	116.1	S150 I158	S150-S156 WeakPolarHBondContact O-CB 3.4Å; S150-S156 PolarHBondContact O-N 3.04Å; S150-S156 WeakPolarHBondContact OG-CB 3.26Å; S156-I158 PolarHBondContact O-N 3.45Å; S156-I158 WeakPolarHBondContact OG-CG1 3.48Å; S156-I158 PolarHBondContact OG-N 3.11Å
157	G	95.9	Very high	95	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.			trans	75.3	2.8	-171	0	0	0	0	0	114.3	T155 R159 L197 V198 H199	T155-G157 PolarHBondContact O-N 2.71Å; G157-R159 PolarHBondContact O-N 2.93Å; G157-L197 CarbonylContact O-C 3.56Å; G157-L197 WeakPolarHBondContact O-CA 3.45Å; G157-V198 VanDerWaalsContact O-CG2 3.3Å; G157-V198 WeakPolarHBondContact O-CG2 3.28Å; G157-V198 PolarHBondContact O-N 3.03Å; G157-H199 VanDerWaalsContact CA-CE1 3.43Å; G157-H199 WeakPolarHBondContact CA-CE1 3.49Å; G157-H199 PolarHBondContact N-CE1 2.75Å; G157-H199 VanDerWaalsContact N-CE1 3.33Å
158	I	97.7	Very high	94.4	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	21%	0.214	C	C	.	.			trans	-67.5	121.7	170.3	-60.3	-66.7	0	0	0	108.6	F134 I146 L151 S156 F192 L197 S208 F210 A211 L214	F134-I158 HydrophobicContact CZ-CD1 4.32Å; I146-I158 HydrophobicContact CD1-CD1 4Å; I146-I158 HydrophobicContact CD1-CG1 4.46Å; L151-I158 HydrophobicContact CD2-CG1 4.3Å; S156-I158 PolarHBondContact O-N 3.45Å; S156-I158 WeakPolarHBondContact OG-CG1 3.48Å; S156-I158 PolarHBondContact OG-N 3.11Å; I158-F192 HydrophobicContact CD1-CD2 4.36Å; I158-F192 HydrophobicContact CD1-CE2 4.31Å; I158-F192 HydrophobicContact CG2-CD2 3.7Å; I158-F192 HydrophobicContact CG2-CE2 3.82Å; I158-L197 HydrophobicContact CD1-CD2 3.76Å; I158-L197 HydrophobicContact CG1-CD2 4.44Å; I158-S208 WeakPolarHBondContact O-CB 3.5Å; I158-S208 PolarHBondContact O-OG 3.27Å; I158-F210 HydrophobicContact CG2-CB 3.72Å; I158-A211 HydrophobicContact CB-CB 4.35Å; I158-L214 HydrophobicContact CD1-CD2 4.32Å; I158-L214 HydrophobicContact CG1-CD2 4.49Å
159	R	96.2	Very high	93.8	Very high	25 Å²	25	52 Å²	52	9%	0.094	25%	0.25	C	C	.	.			trans	-59	162.7	-176.7	65	168.9	-177.3	89.3	-6.4	113.7	G157 E175 M191 D195 V198 S208 F210	G157-R159 PolarHBondContact O-N 2.93Å; R159-E175 IonicContact CZ-OE1 3.21Å; R159-E175 IonicContact CZ-OE2 3.34Å; R159-E175 IonicContact NH1-OE1 2.65Å; R159-E175 PolarHBondContact NH1-OE1 3.06Å; R159-E175 VanDerWaalsContact NH1-OE1 3.12Å; R159-E175 IonicContact NH1-OE2 2.78Å; R159-E175 PolarHBondContact NH1-OE2 3.22Å; R159-E175 IonicContact NH2-OE1 2.7Å; R159-E175 PolarHBondContact NH2-OE1 3.23Å; R159-E175 IonicContact NH2-OE2 3.59Å; R159-M191 PolarHBondContact NH2-O 3.25Å; R159-D195 IonicContact CZ-OD2 3.14Å; R159-D195 IonicContact NE-OD2 2.86Å; R159-D195 PolarHBondContact NE-OD2 3.22Å; R159-D195 IonicContact NH2-OD2 3.78Å; R159-D195 PolarHBondContact NH2-OD2 2.89Å; R159-V198 HydrophobicContact CB-CG1 3.82Å; R159-S208 PolarHBondContact O-OG 3.05Å; R159-F210 VanDerWaalsContact NH1-CE2 3.34Å
160	S	95.1	Very high	93	Very high	46 Å²	46	53.2 Å²	53.2	32%	0.322	26%	0.257	S	S	.	.			trans	-84.3	-173.9	165.9	-149.8	0	0	0	0	111.8	Y207	S160-Y207 WeakPolarHBondContact CB-O 3.32Å; S160-Y207 PolarHBondContact OG-O 2.77Å
161	Y	94.8	Very high	92.4	Very high	21 Å²	21	54.7 Å²	54.7	8%	0.082	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-61.1	138.2	174.3	-62.6	-55.2	0	0	0	111.4	K163 E175 M176 T209 F210 Y311 K312	Y161-K163 PolarHBondContact O-N 3.21Å; Y161-E175 VanDerWaalsContact CA-OE2 3.25Å; Y161-E175 WeakPolarHBondContact CA-OE2 3.47Å; Y161-E175 HydrophobicContact CD1-CB 3.54Å; Y161-E175 HydrophobicContact CE1-CB 4.26Å; Y161-E175 HydrophobicContact CG-CB 4.3Å; Y161-M176 HydrophobicContact CD2-CB 3.99Å; Y161-M176 HydrophobicContact CD2-CE 3.8Å; Y161-M176 HydrophobicContact CD2-CG 4.39Å; Y161-M176 HydrophobicContact CE2-CB 4.11Å; Y161-M176 HydrophobicContact CE2-CE 4.07Å; Y161-M176 HydrophobicContact CE2-CG 4.17Å; Y161-M176 HydrophobicContact CG-CB 4.36Å; Y161-T209 WeakPolarHBondContact OH-CB 3.25Å; Y161-T209 WeakPolarHBondContact OH-CG2 3.36Å; Y161-F210 HydrophobicContact CD1-CD2 4.42Å; Y161-F210 HydrophobicContact CD1-CE1 4.25Å; Y161-F210 AromaticContact CD1-CE2 3.52Å; Y161-F210 HydrophobicContact CD1-CE2 3.52Å; Y161-F210 AromaticContact CD1-CZ 3.44Å; Y161-F210 HydrophobicContact CD1-CZ 3.44Å; Y161-F210 VanDerWaalsContact CD1-CZ 3.44Å; Y161-F210 HydrophobicContact CE1-CD1 4.49Å; Y161-F210 AromaticContact CE1-CE1 3.8Å; Y161-F210 HydrophobicContact CE1-CE1 3.8Å; Y161-F210 AromaticContact CE1-CE2 3.88Å; Y161-F210 HydrophobicContact CE1-CE2 3.88Å; Y161-F210 AromaticContact CE1-CZ 3.45Å; Y161-F210 HydrophobicContact CE1-CZ 3.45Å; Y161-F210 VanDerWaalsContact CE1-CZ 3.45Å; Y161-Y311 HydrophobicContact CE1-CE2 4.28Å; Y161-Y311 WeakPolarHBondContact CE1-OH 3.39Å; Y161-Y311 PolarHBondContact OH-OH 3.21Å; Y161-Y311 VanDerWaalsContact OH-OH 3.09Å; Y161-K312 VanDerWaalsContact OH-CD 3.24Å; Y161-K312 WeakPolarHBondContact OH-CD 3.41Å
162	K	93.7	Very high	91.8	Very high	100 Å²	100	56.7 Å²	56.7	44%	0.435	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-63.2	123.7	174.8	-74.8	171.8	-178.2	165.7	0	109.6	E175 D195	K162-E175 PolarHBondContact N-OE2 3.48Å; K162-D195 IonicContact NZ-OD1 3.21Å; K162-D195 IonicContact NZ-OD2 2.71Å
163	K	90.9	Very high	91.5	Very high	84 Å²	84	58.3 Å²	58.3	37%	0.365	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-87	123.2	172.2	-173.1	-175.9	-174.3	-175.7	0	108.5	Y161 S171 Y173 I441 S443	Y161-K163 PolarHBondContact O-N 3.21Å; K163-S171 WeakPolarHBondContact CE-OG 3.44Å; K163-S171 PolarHBondContact NZ-OG 3.43Å; K163-Y173 HydrophobicContact CB-CD1 4.21Å; K163-Y173 HydrophobicContact CB-CE1 3.69Å; K163-Y173 HydrophobicContact CG-CE1 3.92Å; K163-I441 PolarHBondContact NZ-O 3.05Å; K163-S443 WeakPolarHBondContact CE-OG 3.45Å; K163-S443 PolarHBondContact NZ-OG 3.37Å
164	I	91.7	Very high	91.3	Very high	84 Å²	84	60.9 Å²	60.9	43%	0.431	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	164.3	170.2	71.1	169.1	0	0	0	109.8	S171 V172 P174	I164-S171 WeakPolarHBondContact O-CA 3.37Å; I164-V172 HydrophobicContact CD1-CG2 4.01Å; I164-V172 HydrophobicContact CG1-CG2 3.44Å; I164-V172 VanDerWaalsContact CG1-CG2 3.44Å; I164-V172 PolarHBondContact N-O 3.39Å; I164-V172 PolarHBondContact O-N 3.21Å; I164-P174 HydrophobicContact CD1-CG 3.36Å; I164-P174 HydrophobicContact CG1-CG 3.7Å
165	L	91.6	Very high	91.2	Very high	112 Å²	112	62.2 Å²	62.2	59%	0.586	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.8	170.7	-62.1	179.8	0	0	0	108.7	K170	L165-K170 WeakPolarHBondContact CA-O 3.44Å
166	D	85.9	Confident	90.9	Very high	52 Å²	52	63.8 Å²	63.8	28%	0.278	32%	0.316	S	S	.	.			trans	-74.6	-179.8	168.2	74.9	4.2	0	0	0	111.5	N168 K169 K170 V172	D166-N168 PolarHBondContact O-N 3.28Å; D166-N168 VanDerWaalsContact O-N 3.1Å; D166-N168 VanDerWaalsContact OD1-C 3.32Å; D166-N168 WeakPolarHBondContact OD1-CA 2.96Å; D166-N168 WeakPolarHBondContact OD1-CB 3.19Å; D166-N168 PolarHBondContact OD1-N 2.6Å; D166-K169 PolarHBondContact O-N 3.33Å; D166-K169 PolarHBondContact OD1-N 2.85Å; D166-K169 VanDerWaalsContact OD1-N 3.15Å; D166-K170 PolarHBondContact N-O 3.48Å; D166-K170 WeakPolarHBondContact OD1-CA 3.32Å; D166-K170 WeakPolarHBondContact OD1-CB 3.18Å; D166-K170 PolarHBondContact OD1-N 3.3Å; D166-K170 WeakPolarHBondContact OD2-CB 3.49Å; D166-V172 HydrophobicContact CB-CG1 4.1Å; D166-V172 HydrophobicContact CB-CG2 4.26Å
167	E	87.6	Confident	90.7	Very high	183 Å²	183	67 Å²	67	86%	0.855	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.1	178.1	63.5	-177.4	-174.2	0	0	113.9
168	N	85.6	Confident	90.5	Very high	122 Å²	122	68 Å²	68	65%	0.652	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	11.6	179.3	-62	-58.3	0	0	0	112.5	D166 K170	D166-N168 PolarHBondContact O-N 3.28Å; D166-N168 VanDerWaalsContact O-N 3.1Å; D166-N168 VanDerWaalsContact OD1-C 3.32Å; D166-N168 WeakPolarHBondContact OD1-CA 2.96Å; D166-N168 WeakPolarHBondContact OD1-CB 3.19Å; D166-N168 PolarHBondContact OD1-N 2.6Å; N168-K170 PolarHBondContact O-N 3.02Å
169	K	84.3	Confident	90.2	Very high	172 Å²	172	72.3 Å²	72.3	75%	0.748	37%	0.365	S	S	*	.	S	Bend	trans	59.5	22.2	-173.8	-54.7	-179.5	179.9	178.5	0	113.4	D166	D166-K169 PolarHBondContact O-N 3.33Å; D166-K169 PolarHBondContact OD1-N 2.85Å; D166-K169 VanDerWaalsContact OD1-N 3.15Å
170	K	83	Confident	90	Very high	93 Å²	93	74.8 Å²	74.8	40%	0.404	38%	0.382	S	S	.	.			trans	-82.9	138.4	173	-164.6	170.1	-172.7	156	0	108.9	L165 D166 N168 V172 D297	L165-K170 WeakPolarHBondContact CA-O 3.44Å; D166-K170 PolarHBondContact N-O 3.48Å; D166-K170 WeakPolarHBondContact OD1-CA 3.32Å; D166-K170 WeakPolarHBondContact OD1-CB 3.18Å; D166-K170 PolarHBondContact OD1-N 3.3Å; D166-K170 WeakPolarHBondContact OD2-CB 3.49Å; N168-K170 PolarHBondContact O-N 3.02Å; K170-V172 PolarHBondContact O-N 3.01Å; K170-D297 VanDerWaalsContact NZ-CG 3.26Å; K170-D297 IonicContact NZ-OD1 2.88Å; K170-D297 PolarHBondContact NZ-OD1 3.33Å; K170-D297 IonicContact NZ-OD2 2.73Å; K170-D297 PolarHBondContact NZ-OD2 2.67Å
171	S	84.4	Confident	89.8	Confident	35 Å²	35	77 Å²	77	25%	0.245	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	122.3	175.8	-57.4	0	0	0	0	110.1	K163 I164 S443	K163-S171 WeakPolarHBondContact CE-OG 3.44Å; K163-S171 PolarHBondContact NZ-OG 3.43Å; I164-S171 WeakPolarHBondContact O-CA 3.37Å; S171-S443 WeakPolarHBondContact CB-OG 3.38Å; S171-S443 PolarHBondContact OG-OG 3.19Å; S171-S443 VanDerWaalsContact OG-OG 3.12Å
172	V	86.4	Confident	89.6	Confident	41 Å²	41	77.6 Å²	77.6	25%	0.248	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	155.6	174.7	-59.9	0	0	0	0	110.2	I164 D166 K170 P174	I164-V172 HydrophobicContact CD1-CG2 4.01Å; I164-V172 HydrophobicContact CG1-CG2 3.44Å; I164-V172 VanDerWaalsContact CG1-CG2 3.44Å; I164-V172 PolarHBondContact N-O 3.39Å; I164-V172 PolarHBondContact O-N 3.21Å; D166-V172 HydrophobicContact CB-CG1 4.1Å; D166-V172 HydrophobicContact CB-CG2 4.26Å; K170-V172 PolarHBondContact O-N 3.01Å; V172-P174 WeakPolarHBondContact O-CD 3.48Å
173	Y	91.3	Very high	89.2	Confident	35 Å²	35	77.4 Å²	77.4	14%	0.137	39%	0.39	C	S	.	.			trans	-123.5	82.6	-178.6	-59.3	-89.4	0	0	0	109.2	K163 E175 M176 L177 S443 I444	K163-Y173 HydrophobicContact CB-CD1 4.21Å; K163-Y173 HydrophobicContact CB-CE1 3.69Å; K163-Y173 HydrophobicContact CG-CE1 3.92Å; Y173-E175 PolarHBondContact O-N 3.38Å; Y173-M176 WeakPolarHBondContact O-CA 3.45Å; Y173-M176 VanDerWaalsContact O-CB 3.26Å; Y173-M176 WeakPolarHBondContact O-CB 3.25Å; Y173-M176 PolarHBondContact O-N 2.79Å; Y173-L177 PolarHBondContact O-N 3.1Å; Y173-S443 WeakPolarHBondContact CE2-O 3.47Å; Y173-S443 VanDerWaalsContact OH-C 3.25Å; Y173-S443 PolarHBondContact OH-O 2.8Å; Y173-I444 HydrophobicContact CD2-CG1 4.43Å; Y173-I444 HydrophobicContact CE1-CD1 4.39Å; Y173-I444 HydrophobicContact CE2-CD1 4.16Å; Y173-I444 HydrophobicContact CE2-CG1 3.7Å
174	P	91.9	Very high	89.1	Confident	60 Å²	60	74.4 Å²	74.4	39%	0.39	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-56.4	-36.6	-174.5	-25.4	33.4	0	0	0	113.1	I164 V172 M176 L177 N178	I164-P174 HydrophobicContact CD1-CG 3.36Å; I164-P174 HydrophobicContact CG1-CG 3.7Å; V172-P174 WeakPolarHBondContact O-CD 3.48Å; P174-M176 PolarHBondContact O-N 3.26Å; P174-L177 CarbonylContact O-C 3.51Å; P174-L177 WeakPolarHBondContact O-CA 3.22Å; P174-L177 PolarHBondContact O-N 3.05Å; P174-N178 PolarHBondContact O-N 2.99Å
175	E	93.7	Very high	89.2	Confident	31 Å²	31	71.1 Å²	71.1	15%	0.145	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-65.1	-27.4	177.6	-64	176.1	150.1	0	0	112.8	R159 Y161 K162 Y173 L177 N178 M191 F210 Y311	R159-E175 IonicContact CZ-OE1 3.21Å; R159-E175 IonicContact CZ-OE2 3.34Å; R159-E175 IonicContact NH1-OE1 2.65Å; R159-E175 PolarHBondContact NH1-OE1 3.06Å; R159-E175 VanDerWaalsContact NH1-OE1 3.12Å; R159-E175 IonicContact NH1-OE2 2.78Å; R159-E175 PolarHBondContact NH1-OE2 3.22Å; R159-E175 IonicContact NH2-OE1 2.7Å; R159-E175 PolarHBondContact NH2-OE1 3.23Å; R159-E175 IonicContact NH2-OE2 3.59Å; Y161-E175 VanDerWaalsContact CA-OE2 3.25Å; Y161-E175 WeakPolarHBondContact CA-OE2 3.47Å; Y161-E175 HydrophobicContact CD1-CB 3.54Å; Y161-E175 HydrophobicContact CE1-CB 4.26Å; Y161-E175 HydrophobicContact CG-CB 4.3Å; K162-E175 PolarHBondContact N-OE2 3.48Å; Y173-E175 PolarHBondContact O-N 3.38Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-N178 WeakPolarHBondContact O-CB 3.22Å; E175-M191 HydrophobicContact CB-CE 4.02Å; E175-M191 HydrophobicContact CG-CE 4.3Å; E175-F210 HydrophobicContact CB-CZ 4.24Å; E175-Y311 PolarHBondContact O-OH 2.99Å
176	M	90.6	Very high	89.3	Confident	38 Å²	38	67.4 Å²	67.4	19%	0.187	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-71.5	-31	172.8	-171.8	-174.7	-66.6	0	0	111.5	Y161 Y173 P174 N178 K312 V402 I444	Y161-M176 HydrophobicContact CD2-CB 3.99Å; Y161-M176 HydrophobicContact CD2-CE 3.8Å; Y161-M176 HydrophobicContact CD2-CG 4.39Å; Y161-M176 HydrophobicContact CE2-CB 4.11Å; Y161-M176 HydrophobicContact CE2-CE 4.07Å; Y161-M176 HydrophobicContact CE2-CG 4.17Å; Y161-M176 HydrophobicContact CG-CB 4.36Å; Y173-M176 WeakPolarHBondContact O-CA 3.45Å; Y173-M176 VanDerWaalsContact O-CB 3.26Å; Y173-M176 WeakPolarHBondContact O-CB 3.25Å; Y173-M176 PolarHBondContact O-N 2.79Å; P174-M176 PolarHBondContact O-N 3.26Å; M176-N178 VanDerWaalsContact C-N 3.29Å; M176-K312 PolarHBondContact O-NZ 3.42Å; M176-V402 HydrophobicContact CG-CG2 4.2Å; M176-V402 HydrophobicContact SD-CG2 4.29Å; M176-I444 HydrophobicContact CE-CD1 3.8Å
177	L	91.9	Very high	89.7	Confident	67 Å²	67	67 Å²	67	35%	0.351	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-89.8	15.8	179.4	-56	-179.2	0	0	0	113.2	Y173 P174 E175 T179 I307 V402	Y173-L177 PolarHBondContact O-N 3.1Å; P174-L177 CarbonylContact O-C 3.51Å; P174-L177 WeakPolarHBondContact O-CA 3.22Å; P174-L177 PolarHBondContact O-N 3.05Å; E175-L177 VanDerWaalsContact C-N 3.31Å; L177-T179 PolarHBondContact O-N 3.11Å; L177-I307 HydrophobicContact CB-CG2 4.43Å; L177-I307 HydrophobicContact CD2-CG2 4.24Å; L177-V402 HydrophobicContact CD2-CG1 4.44Å; L177-V402 HydrophobicContact CD2-CG2 3.64Å
178	N	91.9	Very high	90.1	Very high	23 Å²	23	58.3 Å²	58.3	12%	0.123	30%	0.3	C	S	.	.			trans	-58	136.2	-177.3	-168.7	2.8	0	0	0	111.4	P174 E175 M176 V180 F182 M191 D308 Y311	P174-N178 PolarHBondContact O-N 2.99Å; E175-N178 WeakPolarHBondContact O-CB 3.22Å; M176-N178 VanDerWaalsContact C-N 3.29Å; N178-V180 VanDerWaalsContact OD1-CB 3.27Å; N178-V180 WeakPolarHBondContact OD1-CB 3.25Å; N178-V180 WeakPolarHBondContact OD1-CG2 3.34Å; N178-V180 PolarHBondContact OD1-N 3.41Å; N178-F182 WeakPolarHBondContact ND2-CE2 3.42Å; N178-M191 HydrophobicContact CB-CE 4.45Å; N178-M191 WeakPolarHBondContact ND2-CE 3.37Å; N178-M191 PolarHBondContact ND2-SD 2.93Å; N178-D308 PolarHBondContact O-N 2.98Å; N178-Y311 HydrophobicContact CB-CE1 3.89Å
179	T	92.9	Very high	90.6	Very high	94 Å²	94	52.5 Å²	52.5	58%	0.577	27%	0.269	S	S	*	.			trans	-112.6	-0.5	176.1	54.5	0	0	0	0	112.6	L177 T306	L177-T179 PolarHBondContact O-N 3.11Å; T179-T306 VanDerWaalsContact CG2-O 3.27Å; T179-T306 WeakPolarHBondContact CG2-O 3.09Å
180	V	91.7	Very high	91.1	Very high	77 Å²	77	48.1 Å²	48.1	47%	0.467	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-79.2	123.3	-178.9	179.4	0	0	0	0	110	N178 F182	N178-V180 VanDerWaalsContact OD1-CB 3.27Å; N178-V180 WeakPolarHBondContact OD1-CB 3.25Å; N178-V180 WeakPolarHBondContact OD1-CG2 3.34Å; N178-V180 PolarHBondContact OD1-N 3.41Å; V180-F182 HydrophobicContact CB-CE2 4.41Å; V180-F182 HydrophobicContact CG1-CE2 4.35Å; V180-F182 HydrophobicContact CG1-CZ 4.31Å; V180-F182 WeakPolarHBondContact O-CD2 3.21Å
181	R	90.5	Very high	91.7	Very high	93 Å²	93	45.3 Å²	45.3	35%	0.351	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-78	126.5	168.4	-179.7	61.6	-176.1	-146.9	-1.7	110	D308 S310	R181-D308 WeakPolarHBondContact CA-OD2 3.41Å; R181-D308 WeakPolarHBondContact CB-OD2 3.27Å; R181-D308 WeakPolarHBondContact CD-OD2 3.11Å; R181-S310 WeakPolarHBondContact CD-OG 3.49Å; R181-S310 PolarHBondContact NH1-OG 3.44Å
182	F	91.1	Very high	92.3	Very high	33 Å²	33	43.8 Å²	43.8	15%	0.145	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-95.7	144.9	169	-60.7	-94.1	0	0	0	110	N178 V180 D184 N187 A188 M191 Y311	N178-F182 WeakPolarHBondContact ND2-CE2 3.42Å; V180-F182 HydrophobicContact CB-CE2 4.41Å; V180-F182 HydrophobicContact CG1-CE2 4.35Å; V180-F182 HydrophobicContact CG1-CZ 4.31Å; V180-F182 WeakPolarHBondContact O-CD2 3.21Å; F182-D184 VanDerWaalsContact C-N 3.33Å; F182-N187 HydrophobicContact CB-CB 4.46Å; F182-N187 VanDerWaalsContact CD1-C 3.47Å; F182-N187 HydrophobicContact CD1-CB 4.29Å; F182-N187 VanDerWaalsContact CD1-O 3.25Å; F182-N187 WeakPolarHBondContact CD1-O 3.24Å; F182-N187 WeakPolarHBondContact CE1-O 3.24Å; F182-A188 HydrophobicContact CB-CB 4.07Å; F182-A188 HydrophobicContact CD1-CB 4.39Å; F182-A188 HydrophobicContact CD2-CB 4.18Å; F182-A188 HydrophobicContact CG-CB 3.96Å; F182-M191 HydrophobicContact CE1-CG 4.22Å; F182-M191 HydrophobicContact CE2-CG 4.29Å; F182-M191 HydrophobicContact CE2-SD 3.78Å; F182-M191 HydrophobicContact CZ-CG 3.54Å; F182-M191 HydrophobicContact CZ-SD 3.65Å; F182-Y311 HydrophobicContact CD2-CG 4.47Å; F182-Y311 HydrophobicContact CE2-CG 4.32Å
183	N	85.1	Confident	92.8	Very high	96 Å²	96	44.2 Å²	44.2	51%	0.513	23%	0.23	S	C	.	.	S	Bend	trans	-71.9	-29.4	-178.3	-69.2	-25.3	0	0	0	112.7
184	D	89	Confident	93	Very high	21 Å²	21	48.5 Å²	48.5	11%	0.112	26%	0.256	C	S	.	.	S	Bend	trans	-155	174.3	-179.5	59.9	63.6	0	0	0	110.7	F182 L186 N187 A188 N253	F182-D184 VanDerWaalsContact C-N 3.33Å; D184-L186 PolarHBondContact OD1-N 2.88Å; D184-N187 PolarHBondContact OD1-N 3.4Å; D184-N187 PolarHBondContact OD2-ND2 3.34Å; D184-A188 PolarHBondContact O-N 2.83Å; D184-N253 PolarHBondContact OD2-ND2 3.34Å
185	T	93.4	Very high	93.2	Very high	16 Å²	16	47.9 Å²	47.9	10%	0.098	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-30.2	-176.5	62.2	0	0	0	0	113.6	A188 C189 S216 A217 E220 F261	T185-A188 WeakPolarHBondContact O-CB 3.34Å; T185-A188 PolarHBondContact O-N 3.33Å; T185-C189 PolarHBondContact O-N 3.28Å; T185-C189 PolarHBondContact O-SG 3.43Å; T185-S216 VanDerWaalsContact CB-OG 3.3Å; T185-S216 WeakPolarHBondContact CB-OG 3.43Å; T185-S216 WeakPolarHBondContact CG2-OG 3.47Å; T185-A217 WeakPolarHBondContact OG1-CA 3.41Å; T185-A217 WeakPolarHBondContact OG1-CB 3.24Å; T185-E220 VanDerWaalsContact CG2-CD 3.5Å; T185-E220 HydrophobicContact CG2-CG 4.34Å; T185-E220 WeakPolarHBondContact CG2-OE2 3.39Å; T185-E220 PolarHBondContact OG1-OE2 2.84Å; T185-F261 HydrophobicContact CG2-CB 4.02Å
186	L	93.7	Very high	93.3	Very high	33 Å²	33	52.2 Å²	52.2	17%	0.173	28%	0.278	C	S	.	.	H	α-helix	trans	-74.9	-40.8	179.9	-177.8	58.3	0	0	0	110.6	L131 E133 D184 A188 C189	L131-L186 HydrophobicContact CD1-CD1 4.21Å; L131-L186 HydrophobicContact CD2-CD1 4.28Å; E133-L186 HydrophobicContact CB-CD2 4.14Å; D184-L186 PolarHBondContact OD1-N 2.88Å; L186-A188 VanDerWaalsContact C-N 3.29Å; L186-A188 PolarHBondContact O-N 3.29Å; L186-C189 WeakPolarHBondContact O-CA 3.2Å; L186-C189 WeakPolarHBondContact O-CB 3.4Å; L186-C189 PolarHBondContact O-N 3.41Å
187	N	94.2	Very high	93.6	Very high	43 Å²	43	51.1 Å²	51.1	23%	0.23	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-35.7	173	-69.1	-20.7	0	0	0	111.4	F182 D184 C189 D190	F182-N187 HydrophobicContact CB-CB 4.46Å; F182-N187 VanDerWaalsContact CD1-C 3.47Å; F182-N187 HydrophobicContact CD1-CB 4.29Å; F182-N187 VanDerWaalsContact CD1-O 3.25Å; F182-N187 WeakPolarHBondContact CD1-O 3.24Å; F182-N187 WeakPolarHBondContact CE1-O 3.24Å; D184-N187 PolarHBondContact OD1-N 3.4Å; D184-N187 PolarHBondContact OD2-ND2 3.34Å; N187-C189 PolarHBondContact O-N 2.76Å; N187-D190 WeakPolarHBondContact O-CB 3.36Å; N187-D190 VanDerWaalsContact O-CG 3.29Å; N187-D190 PolarHBondContact O-N 2.61Å
188	A	95.4	Very high	93.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-27.6	171.2	0	0	0	0	0	112.9	F182 D184 T185 L186 D190 T213	F182-A188 HydrophobicContact CB-CB 4.07Å; F182-A188 HydrophobicContact CD1-CB 4.39Å; F182-A188 HydrophobicContact CD2-CB 4.18Å; F182-A188 HydrophobicContact CG-CB 3.96Å; D184-A188 PolarHBondContact O-N 2.83Å; T185-A188 WeakPolarHBondContact O-CB 3.34Å; T185-A188 PolarHBondContact O-N 3.33Å; L186-A188 VanDerWaalsContact C-N 3.29Å; L186-A188 PolarHBondContact O-N 3.29Å; A188-D190 PolarHBondContact O-N 2.75Å; A188-T213 HydrophobicContact CB-CG2 3.77Å
189	C	96.8	Very high	93.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-69.3	-16.4	174.8	-59.6	0	0	0	0	112.8	T185 L186 N187 M191 F192 K193	T185-C189 PolarHBondContact O-N 3.28Å; T185-C189 PolarHBondContact O-SG 3.43Å; L186-C189 WeakPolarHBondContact O-CA 3.2Å; L186-C189 WeakPolarHBondContact O-CB 3.4Å; L186-C189 PolarHBondContact O-N 3.41Å; N187-C189 PolarHBondContact O-N 2.76Å; C189-M191 PolarHBondContact O-N 3.36Å; C189-F192 HydrophobicContact CB-CE1 4.15Å; C189-F192 HydrophobicContact CB-CZ 3.99Å; C189-F192 PolarHBondContact O-N 3.02Å; C189-K193 HydrophobicContact CB-CB 4.19Å; C189-K193 WeakPolarHBondContact O-CB 3.44Å; C189-K193 PolarHBondContact O-N 3.26Å
190	D	95.4	Very high	93.8	Very high	80 Å²	80	50 Å²	50	43%	0.428	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-57	-24.1	177.5	-69.7	-13.1	0	0	0	113.1	N187 A188 F192 K193	N187-D190 WeakPolarHBondContact O-CB 3.36Å; N187-D190 VanDerWaalsContact O-CG 3.29Å; N187-D190 PolarHBondContact O-N 2.61Å; A188-D190 PolarHBondContact O-N 2.75Å; D190-F192 PolarHBondContact O-N 3.26Å; D190-K193 VanDerWaalsContact OD1-CD 3.32Å; D190-K193 WeakPolarHBondContact OD1-CD 3.38Å; D190-K193 WeakPolarHBondContact OD1-CE 3.43Å; D190-K193 IonicContact OD1-NZ 3.53Å; D190-K193 PolarHBondContact OD1-NZ 3.4Å
191	M	95	Very high	94	Very high	34 Å²	34	47.5 Å²	47.5	17%	0.167	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-60.2	-27.7	174.8	-64.2	-178.1	70.4	0	0	113.5	R159 E175 N178 F182 C189 F210 Y311	R159-M191 PolarHBondContact NH2-O 3.25Å; E175-M191 HydrophobicContact CB-CE 4.02Å; E175-M191 HydrophobicContact CG-CE 4.3Å; N178-M191 HydrophobicContact CB-CE 4.45Å; N178-M191 WeakPolarHBondContact ND2-CE 3.37Å; N178-M191 PolarHBondContact ND2-SD 2.93Å; F182-M191 HydrophobicContact CE1-CG 4.22Å; F182-M191 HydrophobicContact CE2-CG 4.29Å; F182-M191 HydrophobicContact CE2-SD 3.78Å; F182-M191 HydrophobicContact CZ-CG 3.54Å; F182-M191 HydrophobicContact CZ-SD 3.65Å; C189-M191 PolarHBondContact O-N 3.36Å; M191-F210 HydrophobicContact CB-CE1 4.03Å; M191-F210 HydrophobicContact CB-CZ 4.28Å; M191-F210 HydrophobicContact CE-CE1 3.82Å; M191-F210 HydrophobicContact CE-CZ 3.81Å; M191-F210 HydrophobicContact SD-CE1 3.92Å; M191-F210 HydrophobicContact SD-CZ 4.47Å; M191-Y311 HydrophobicContact CE-CE2 4.42Å; M191-Y311 HydrophobicContact SD-CD2 3.96Å; M191-Y311 HydrophobicContact SD-CE2 4.09Å; M191-Y311 HydrophobicContact SD-CG 4.29Å
192	F	96.4	Very high	94.1	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.018	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-146.1	-10.2	-171.7	67.3	-87.9	0	0	0	115.6	F134 I158 C189 D190 N194 D195 F210 T213 L214	F134-F192 HydrophobicContact CE2-CE2 4.34Å; I158-F192 HydrophobicContact CD1-CD2 4.36Å; I158-F192 HydrophobicContact CD1-CE2 4.31Å; I158-F192 HydrophobicContact CG2-CD2 3.7Å; I158-F192 HydrophobicContact CG2-CE2 3.82Å; C189-F192 HydrophobicContact CB-CE1 4.15Å; C189-F192 HydrophobicContact CB-CZ 3.99Å; C189-F192 PolarHBondContact O-N 3.02Å; D190-F192 PolarHBondContact O-N 3.26Å; F192-N194 PolarHBondContact O-N 3.33Å; F192-N194 VanDerWaalsContact O-N 3.09Å; F192-D195 WeakPolarHBondContact CA-OD2 3.28Å; F192-D195 WeakPolarHBondContact O-CB 3.36Å; F192-D195 PolarHBondContact O-N 2.97Å; F192-F210 HydrophobicContact CB-CD2 4.17Å; F192-F210 HydrophobicContact CB-CG 4.23Å; F192-F210 HydrophobicContact CD1-CB 3.51Å; F192-F210 AromaticContact CD1-CD1 3.24Å; F192-F210 HydrophobicContact CD1-CD1 3.24Å; F192-F210 HydrophobicContact CD1-CD2 4.11Å; F192-F210 AromaticContact CD1-CE1 3.92Å; F192-F210 HydrophobicContact CD1-CE1 3.92Å; F192-F210 AromaticContact CD1-CG 3.35Å; F192-F210 HydrophobicContact CD1-CG 3.35Å; F192-F210 HydrophobicContact CD2-CB 3.98Å; F192-F210 HydrophobicContact CE1-CB 3.55Å; F192-F210 AromaticContact CE1-CD1 3.51Å; F192-F210 HydrophobicContact CE1-CD1 3.51Å; F192-F210 HydrophobicContact CE1-CE1 4.44Å; F192-F210 AromaticContact CE1-CG 3.77Å; F192-F210 HydrophobicContact CE1-CG 3.77Å; F192-F210 HydrophobicContact CE2-CB 4.03Å; F192-F210 HydrophobicContact CG-CB 3.73Å; F192-F210 HydrophobicContact CG-CD1 4.14Å; F192-F210 HydrophobicContact CG-CD2 4.22Å; F192-F210 AromaticContact CG-CG 3.78Å; F192-F210 HydrophobicContact CG-CG 3.78Å; F192-F210 HydrophobicContact CZ-CB 3.83Å; F192-F210 WeakPolarHBondContact CZ-O 3.18Å; F192-T213 HydrophobicContact CE1-CG2 4.05Å; F192-L214 HydrophobicContact CE2-CB 4.2Å; F192-L214 HydrophobicContact CZ-CB 3.96Å
193	K	96.6	Very high	94	Very high	49 Å²	49	49.6 Å²	49.6	21%	0.213	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.4	-171.6	72.8	-176.6	-168.6	-172.2	0	113.2	F134 P135 K137 C189 D190	F134-K193 HydrophobicContact CD2-CB 4.18Å; F134-K193 HydrophobicContact CE2-CB 3.62Å; F134-K193 HydrophobicContact CZ-CB 4.28Å; P135-K193 HydrophobicContact CG-CB 4.12Å; P135-K193 HydrophobicContact CG-CG 4.35Å; P135-K193 WeakPolarHBondContact CG-O 3.31Å; K137-K193 PolarHBondContact NZ-O 3.09Å; C189-K193 HydrophobicContact CB-CB 4.19Å; C189-K193 WeakPolarHBondContact O-CB 3.44Å; C189-K193 PolarHBondContact O-N 3.26Å; D190-K193 VanDerWaalsContact OD1-CD 3.32Å; D190-K193 WeakPolarHBondContact OD1-CD 3.38Å; D190-K193 WeakPolarHBondContact OD1-CE 3.43Å; D190-K193 IonicContact OD1-NZ 3.53Å; D190-K193 PolarHBondContact OD1-NZ 3.4Å
194	N	96.4	Very high	94.3	Very high	126 Å²	126	50.5 Å²	50.5	67%	0.674	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-5.1	178.8	-64.3	-28.8	0	0	0	113.6	F192	F192-N194 PolarHBondContact O-N 3.33Å; F192-N194 VanDerWaalsContact O-N 3.09Å
195	D	96.1	Very high	94.5	Very high	47 Å²	47	52 Å²	52	25%	0.251	29%	0.287	S	S	.	.	S	Bend	trans	-73.5	150	177.8	-64.6	-42.7	0	0	0	110.9	K137 R159 K162 F192	K137-D195 PolarHBondContact NZ-O 3.26Å; R159-D195 IonicContact CZ-OD2 3.14Å; R159-D195 IonicContact NE-OD2 2.86Å; R159-D195 PolarHBondContact NE-OD2 3.22Å; R159-D195 IonicContact NH2-OD2 3.78Å; R159-D195 PolarHBondContact NH2-OD2 2.89Å; K162-D195 IonicContact NZ-OD1 3.21Å; K162-D195 IonicContact NZ-OD2 2.71Å; F192-D195 WeakPolarHBondContact CA-OD2 3.28Å; F192-D195 WeakPolarHBondContact O-CB 3.36Å; F192-D195 PolarHBondContact O-N 2.97Å
196	T	94.9	Very high	94.4	Very high	121 Å²	121	52.7 Å²	52.7	74%	0.742	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-65.5	150	173.9	53.9	0	0	0	0	111
197	L	96.8	Very high	94.4	Very high	16 Å²	16	54 Å²	54	8%	0.084	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-67.4	142.8	170.3	-58.6	-178.4	0	0	0	109.7	K137 V139 A144 I146 G157 I158 H199 P201	K137-L197 HydrophobicContact CB-CD1 3.78Å; K137-L197 HydrophobicContact CB-CG 4.06Å; K137-L197 HydrophobicContact CD-CD2 4.21Å; K137-L197 HydrophobicContact CD-CG 4.25Å; K137-L197 HydrophobicContact CG-CD1 4.14Å; K137-L197 HydrophobicContact CG-CD2 4.11Å; K137-L197 HydrophobicContact CG-CG 4.08Å; V139-L197 HydrophobicContact CG2-CB 3.94Å; V139-L197 HydrophobicContact CG2-CD1 4.09Å; V139-L197 HydrophobicContact CG2-CG 4.32Å; A144-L197 HydrophobicContact CB-CD1 3.64Å; I146-L197 HydrophobicContact CD1-CD1 4.43Å; I146-L197 HydrophobicContact CD1-CD2 4.08Å; G157-L197 CarbonylContact O-C 3.56Å; G157-L197 WeakPolarHBondContact O-CA 3.45Å; I158-L197 HydrophobicContact CD1-CD2 3.76Å; I158-L197 HydrophobicContact CG1-CD2 4.44Å; L197-H199 VanDerWaalsContact C-N 3.29Å; L197-H199 WeakPolarHBondContact CB-O 3.33Å; L197-P201 HydrophobicContact CD1-CG 3.96Å
198	V	94.4	Very high	94.5	Very high	81 Å²	81	52 Å²	52	49%	0.491	28%	0.284	S	S	.	.	S	Bend	trans	-75.6	-21.8	178.5	-67.4	0	0	0	0	112.7	G157 R159 T206	G157-V198 VanDerWaalsContact O-CG2 3.3Å; G157-V198 WeakPolarHBondContact O-CG2 3.28Å; G157-V198 PolarHBondContact O-N 3.03Å; R159-V198 HydrophobicContact CB-CG1 3.82Å; V198-T206 HydrophobicContact CG2-CG2 4.05Å
199	H	93.1	Very high	94.6	Very high	14 Å²	14	52.5 Å²	52.5	7%	0.065	29%	0.287	C	S	.	.	S	Bend	trans	-159.4	169.8	173.2	56	77.1	0	0	0	108.6	T155 G157 L197 E204 T206	T155-H199 PolarHBondContact O-CE1 3.29Å; G157-H199 VanDerWaalsContact CA-CE1 3.43Å; G157-H199 WeakPolarHBondContact CA-CE1 3.49Å; G157-H199 PolarHBondContact N-CE1 2.75Å; G157-H199 VanDerWaalsContact N-CE1 3.33Å; L197-H199 VanDerWaalsContact C-N 3.29Å; L197-H199 WeakPolarHBondContact CB-O 3.33Å; H199-E204 HydrophobicContact CB-CB 4.21Å; H199-E204 PolarHBondContact CE1-O 2.61Å; H199-E204 PolarHBondContact NE2-O 2.68Å; H199-T206 PolarHBondContact CD2-OG1 2.96Å; H199-T206 VanDerWaalsContact CD2-OG1 3.28Å; H199-T206 PolarHBondContact NE2-OG1 2.98Å
200	L	94.4	Very high	94.6	Very high	64 Å²	64	52.5 Å²	52.5	34%	0.335	29%	0.287	S	S	.	.			trans	-65	144.4	173.5	-80.5	168.6	0	0	0	111.4	V139 A144 G202 I203	V139-L200 HydrophobicContact CB-CD2 3.66Å; V139-L200 HydrophobicContact CB-CG 4.21Å; V139-L200 HydrophobicContact CG1-CD2 3.99Å; V139-L200 HydrophobicContact CG1-CG 3.96Å; V139-L200 HydrophobicContact CG2-CD2 4.22Å; A144-L200 HydrophobicContact CB-CD2 4.11Å; L200-G202 PolarHBondContact O-N 3.06Å; L200-I203 HydrophobicContact CB-CG1 3.65Å; L200-I203 PolarHBondContact O-N 2.8Å
201	P	95.6	Very high	94.8	Very high	25 Å²	25	48.7 Å²	48.7	16%	0.162	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	136.6	174.5	-26.5	35	0	0	0	112.4	A144 K145 I146 T155 L197 I203	A144-P201 HydrophobicContact CB-CG 4.08Å; K145-P201 VanDerWaalsContact O-CB 3.26Å; K145-P201 WeakPolarHBondContact O-CB 3.38Å; K145-P201 WeakPolarHBondContact O-CG 3.48Å; I146-P201 HydrophobicContact CG1-CG 3.94Å; T155-P201 CarbonylContact O-C 3.43Å; T155-P201 VanDerWaalsContact O-CA 3.24Å; T155-P201 WeakPolarHBondContact O-CA 3.48Å; L197-P201 HydrophobicContact CD1-CG 3.96Å; P201-I203 VanDerWaalsContact C-N 3.3Å; P201-I203 PolarHBondContact O-N 3.31Å
202	G	91.6	Very high	94.9	Very high	52 Å²	52	47.1 Å²	47.1	54%	0.536	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-11	178.3	0	0	0	0	0	115.7	T155 L200	T155-G202 PolarHBondContact O-N 3.13Å; T155-G202 WeakPolarHBondContact OG1-CA 3.42Å; L200-G202 PolarHBondContact O-N 3.06Å
203	I	89.5	Confident	95	Very high	119 Å²	119	46.9 Å²	46.9	61%	0.61	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-53.6	-172.7	-55.3	-56.1	0	0	0	112.7	L200 P201	L200-I203 HydrophobicContact CB-CG1 3.65Å; L200-I203 PolarHBondContact O-N 2.8Å; P201-I203 VanDerWaalsContact C-N 3.3Å; P201-I203 PolarHBondContact O-N 3.31Å
204	E	91.4	Very high	95.1	Very high	115 Å²	115	44.6 Å²	44.6	54%	0.537	25%	0.247	S	C	.	.	S	Bend	trans	-121.2	161.2	-176.3	-77.2	173.1	-142.4	0	0	111.3	T155 H199	T155-E204 VanDerWaalsContact CA-O 3.24Å; T155-E204 WeakPolarHBondContact CA-O 3.35Å; T155-E204 VanDerWaalsContact CB-O 3.32Å; T155-E204 WeakPolarHBondContact CB-O 3.43Å; T155-E204 WeakPolarHBondContact CG2-O 3.44Å; H199-E204 HydrophobicContact CB-CB 4.21Å; H199-E204 PolarHBondContact CE1-O 2.61Å; H199-E204 PolarHBondContact NE2-O 2.68Å
205	Y	92.8	Very high	95.2	Very high	51 Å²	51	38.6 Å²	38.6	20%	0.2	22%	0.215	C	C	.	.			trans	-97.7	120.2	176	175.4	-91.6	0	0	0	110.4	N153 H154 Y207 P362 P369 F374	N153-Y205 WeakPolarHBondContact O-CD2 3.48Å; H154-Y205 HydrophobicContact CB-CD2 3.85Å; H154-Y205 HydrophobicContact CB-CE2 3.54Å; Y205-Y207 WeakPolarHBondContact OH-CD2 3.4Å; Y205-P362 HydrophobicContact CD1-CB 3.81Å; Y205-P362 HydrophobicContact CD2-CB 4.44Å; Y205-P362 HydrophobicContact CE1-CB 4.21Å; Y205-P362 HydrophobicContact CG-CB 3.92Å; Y205-P369 HydrophobicContact CD2-CG 3.73Å; Y205-P369 HydrophobicContact CE2-CB 4Å; Y205-P369 HydrophobicContact CE2-CG 3.27Å; Y205-F374 WeakPolarHBondContact OH-CE1 3.49Å
206	T	92.9	Very high	95.3	Very high	32 Å²	32	36.5 Å²	36.5	20%	0.196	21%	0.205	C	C	.	.			trans	-131.5	103.5	174	-64	0	0	0	0	110.6	H154 V198 H199 S208	H154-T206 WeakPolarHBondContact CB-O 3.46Å; H154-T206 CarbonylContact O-C 3.35Å; H154-T206 PolarHBondContact O-N 2.94Å; V198-T206 HydrophobicContact CG2-CG2 4.05Å; H199-T206 PolarHBondContact CD2-OG1 2.96Å; H199-T206 VanDerWaalsContact CD2-OG1 3.28Å; H199-T206 PolarHBondContact NE2-OG1 2.98Å; T206-S208 PolarHBondContact O-N 3.23Å; T206-S208 VanDerWaalsContact O-N 3.08Å
207	Y	93.7	Very high	95.4	Very high	61 Å²	61	30.9 Å²	30.9	24%	0.239	17%	0.17	C	C	.	.			trans	-59.6	115.9	178.5	-166.9	-92.8	0	0	0	111.9	S102 K105 H154 S160 Y205 F374 H397	S102-Y207 WeakPolarHBondContact CB-OH 3.18Å; S102-Y207 PolarHBondContact OG-OH 2.83Å; K105-Y207 HydrophobicContact CD-CE2 4.4Å; K105-Y207 WeakPolarHBondContact CD-OH 3.5Å; K105-Y207 WeakPolarHBondContact CE-OH 3.25Å; K105-Y207 PolarHBondContact NZ-OH 3.35Å; H154-Y207 AromaticContact CD2-CD2 3.48Å; H154-Y207 VanDerWaalsContact CD2-CD2 3.48Å; H154-Y207 WeakPolarHBondContact CD2-CD2 3.24Å; H154-Y207 AromaticContact CD2-CE2 3.77Å; H154-Y207 AromaticContact CE1-CD2 3.71Å; H154-Y207 AromaticContact CE1-CE2 3.71Å; H154-Y207 AromaticContact CG-CD2 3.96Å; H154-Y207 AromaticContact NE2-CD2 3.3Å; H154-Y207 VanDerWaalsContact NE2-CD2 3.3Å; H154-Y207 WeakPolarHBondContact NE2-CD2 3.18Å; H154-Y207 AromaticContact NE2-CE2 3.14Å; H154-Y207 WeakPolarHBondContact NE2-CE2 3.15Å; H154-Y207 AromaticContact NE2-CZ 3.97Å; S160-Y207 WeakPolarHBondContact CB-O 3.32Å; S160-Y207 PolarHBondContact OG-O 2.77Å; Y205-Y207 WeakPolarHBondContact OH-CD2 3.4Å; Y207-F374 HydrophobicContact CD2-CZ 4.17Å; Y207-F374 HydrophobicContact CE2-CE2 4.26Å; Y207-F374 AromaticContact CE2-CZ 3.82Å; Y207-F374 HydrophobicContact CE2-CZ 3.82Å; Y207-H397 PolarHBondContact OH-CE1 3.27Å; Y207-H397 VanDerWaalsContact OH-CE1 3.26Å
208	S	96	Very high	95.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.			trans	-134.6	122.6	-172.5	-179	0	0	0	0	112.4	H154 I158 R159 T206 F210 A211	H154-S208 PolarHBondContact CE1-O 2.81Å; H154-S208 PolarHBondContact ND1-N 3.22Å; H154-S208 VanDerWaalsContact ND1-N 3.2Å; H154-S208 PolarHBondContact ND1-O 2.58Å; I158-S208 WeakPolarHBondContact O-CB 3.5Å; I158-S208 PolarHBondContact O-OG 3.27Å; R159-S208 PolarHBondContact O-OG 3.05Å; T206-S208 PolarHBondContact O-N 3.23Å; T206-S208 VanDerWaalsContact O-N 3.08Å; S208-F210 VanDerWaalsContact C-N 3.33Å; S208-F210 PolarHBondContact OG-N 3.14Å; S208-A211 PolarHBondContact OG-N 3.48Å
209	T	96.7	Very high	95.7	Very high	12 Å²	12	26.2 Å²	26.2	7%	0.074	14%	0.143	C	C	.	.	H	α-helix	trans	-74.9	-28.2	167.8	-60.5	0	0	0	0	111.2	Y161 A211 F212 T213 K312	Y161-T209 WeakPolarHBondContact OH-CB 3.25Å; Y161-T209 WeakPolarHBondContact OH-CG2 3.36Å; T209-A211 VanDerWaalsContact C-N 3.33Å; T209-A211 PolarHBondContact O-N 3.45Å; T209-F212 PolarHBondContact O-N 3.1Å; T209-T213 PolarHBondContact O-N 2.86Å; T209-T213 PolarHBondContact O-OG1 3.32Å; T209-T213 VanDerWaalsContact O-OG1 3.1Å; T209-K312 HydrophobicContact CG2-CB 3.74Å; T209-K312 HydrophobicContact CG2-CD 4.04Å; T209-K312 HydrophobicContact CG2-CG 4.5Å
210	F	97.9	Very high	95.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.3	-32.9	175.2	-69.8	-45.5	0	0	0	112.5	I158 R159 Y161 E175 M191 F192 S208 F212 T213 L214 Y311	I158-F210 HydrophobicContact CG2-CB 3.72Å; R159-F210 VanDerWaalsContact NH1-CE2 3.34Å; Y161-F210 HydrophobicContact CD1-CD2 4.42Å; Y161-F210 HydrophobicContact CD1-CE1 4.25Å; Y161-F210 AromaticContact CD1-CE2 3.52Å; Y161-F210 HydrophobicContact CD1-CE2 3.52Å; Y161-F210 AromaticContact CD1-CZ 3.44Å; Y161-F210 HydrophobicContact CD1-CZ 3.44Å; Y161-F210 VanDerWaalsContact CD1-CZ 3.44Å; Y161-F210 HydrophobicContact CE1-CD1 4.49Å; Y161-F210 AromaticContact CE1-CE1 3.8Å; Y161-F210 HydrophobicContact CE1-CE1 3.8Å; Y161-F210 AromaticContact CE1-CE2 3.88Å; Y161-F210 HydrophobicContact CE1-CE2 3.88Å; Y161-F210 AromaticContact CE1-CZ 3.45Å; Y161-F210 HydrophobicContact CE1-CZ 3.45Å; Y161-F210 VanDerWaalsContact CE1-CZ 3.45Å; E175-F210 HydrophobicContact CB-CZ 4.24Å; M191-F210 HydrophobicContact CB-CE1 4.03Å; M191-F210 HydrophobicContact CB-CZ 4.28Å; M191-F210 HydrophobicContact CE-CE1 3.82Å; M191-F210 HydrophobicContact CE-CZ 3.81Å; M191-F210 HydrophobicContact SD-CE1 3.92Å; M191-F210 HydrophobicContact SD-CZ 4.47Å; F192-F210 HydrophobicContact CB-CD2 4.17Å; F192-F210 HydrophobicContact CB-CG 4.23Å; F192-F210 HydrophobicContact CD1-CB 3.51Å; F192-F210 AromaticContact CD1-CD1 3.24Å; F192-F210 HydrophobicContact CD1-CD1 3.24Å; F192-F210 HydrophobicContact CD1-CD2 4.11Å; F192-F210 AromaticContact CD1-CE1 3.92Å; F192-F210 HydrophobicContact CD1-CE1 3.92Å; F192-F210 AromaticContact CD1-CG 3.35Å; F192-F210 HydrophobicContact CD1-CG 3.35Å; F192-F210 HydrophobicContact CD2-CB 3.98Å; F192-F210 HydrophobicContact CE1-CB 3.55Å; F192-F210 AromaticContact CE1-CD1 3.51Å; F192-F210 HydrophobicContact CE1-CD1 3.51Å; F192-F210 HydrophobicContact CE1-CE1 4.44Å; F192-F210 AromaticContact CE1-CG 3.77Å; F192-F210 HydrophobicContact CE1-CG 3.77Å; F192-F210 HydrophobicContact CE2-CB 4.03Å; F192-F210 HydrophobicContact CG-CB 3.73Å; F192-F210 HydrophobicContact CG-CD1 4.14Å; F192-F210 HydrophobicContact CG-CD2 4.22Å; F192-F210 AromaticContact CG-CG 3.78Å; F192-F210 HydrophobicContact CG-CG 3.78Å; F192-F210 HydrophobicContact CZ-CB 3.83Å; F192-F210 WeakPolarHBondContact CZ-O 3.18Å; S208-F210 VanDerWaalsContact C-N 3.33Å; S208-F210 PolarHBondContact OG-N 3.14Å; F210-F212 VanDerWaalsContact C-N 3.25Å; F210-F212 PolarHBondContact O-N 3.01Å; F210-T213 WeakPolarHBondContact O-CA 3.47Å; F210-T213 WeakPolarHBondContact O-CB 3.5Å; F210-T213 PolarHBondContact O-N 3.33Å; F210-T213 VanDerWaalsContact O-N 3.08Å; F210-L214 PolarHBondContact O-N 2.89Å; F210-Y311 HydrophobicContact CE1-CE2 4.01Å
211	A	98.3	Very high	95.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57	-39.5	170.5	0	0	0	0	0	112.3	L151 I158 S208 T209 L215	L151-A211 HydrophobicContact CB-CB 4.5Å; L151-A211 HydrophobicContact CD2-CB 3.88Å; I158-A211 HydrophobicContact CB-CB 4.35Å; S208-A211 PolarHBondContact OG-N 3.48Å; T209-A211 VanDerWaalsContact C-N 3.33Å; T209-A211 PolarHBondContact O-N 3.45Å; A211-L215 WeakPolarHBondContact O-CB 3.45Å; A211-L215 PolarHBondContact O-N 3.26Å
212	F	98.5	Very high	96	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-75.5	-30	175.2	-82.1	-102.3	0	0	0	113	K105 T108 L152 H154 T209 F210 L215 S216 A314	K105-F212 HydrophobicContact CB-CD1 3.99Å; K105-F212 HydrophobicContact CB-CE1 3.44Å; K105-F212 VanDerWaalsContact CB-CE1 3.44Å; K105-F212 HydrophobicContact CB-CE2 4.43Å; K105-F212 HydrophobicContact CB-CZ 3.7Å; K105-F212 HydrophobicContact CD-CD1 4.31Å; K105-F212 HydrophobicContact CD-CD2 3.83Å; K105-F212 HydrophobicContact CD-CE1 4.08Å; K105-F212 HydrophobicContact CD-CE2 3.6Å; K105-F212 HydrophobicContact CD-CG 4.19Å; K105-F212 HydrophobicContact CD-CZ 3.72Å; K105-F212 HydrophobicContact CG-CD1 3.64Å; K105-F212 HydrophobicContact CG-CD2 4.06Å; K105-F212 HydrophobicContact CG-CE1 3.55Å; K105-F212 HydrophobicContact CG-CE2 4Å; K105-F212 HydrophobicContact CG-CG 3.89Å; K105-F212 HydrophobicContact CG-CZ 3.74Å; T108-F212 HydrophobicContact CG2-CD1 4.05Å; T108-F212 HydrophobicContact CG2-CE1 4.4Å; L152-F212 HydrophobicContact CD2-CE1 3.95Å; L152-F212 HydrophobicContact CD2-CZ 3.96Å; H154-F212 AromaticContact CE1-CD2 3.78Å; H154-F212 AromaticContact CE1-CE2 3.36Å; H154-F212 WeakPolarHBondContact CE1-CE2 3.26Å; H154-F212 AromaticContact NE2-CE2 3.74Å; T209-F212 PolarHBondContact O-N 3.1Å; F210-F212 VanDerWaalsContact C-N 3.25Å; F210-F212 PolarHBondContact O-N 3.01Å; F212-L215 HydrophobicContact CD1-CD2 4.38Å; F212-L215 HydrophobicContact CE1-CD2 4.43Å; F212-L215 PolarHBondContact O-N 2.97Å; F212-S216 PolarHBondContact O-N 2.97Å; F212-A314 HydrophobicContact CB-CB 4.2Å; F212-A314 WeakPolarHBondContact CD1-O 3.45Å; F212-A314 WeakPolarHBondContact O-CB 3.31Å
213	T	98	Very high	96.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.2	-47.4	170.8	-55.1	0	0	0	0	110.1	A188 F192 T209 F210 L215 S216 Y311	A188-T213 HydrophobicContact CB-CG2 3.77Å; F192-T213 HydrophobicContact CE1-CG2 4.05Å; T209-T213 PolarHBondContact O-N 2.86Å; T209-T213 PolarHBondContact O-OG1 3.32Å; T209-T213 VanDerWaalsContact O-OG1 3.1Å; F210-T213 WeakPolarHBondContact O-CA 3.47Å; F210-T213 WeakPolarHBondContact O-CB 3.5Å; F210-T213 PolarHBondContact O-N 3.33Å; F210-T213 VanDerWaalsContact O-N 3.08Å; T213-L215 PolarHBondContact O-N 3.08Å; T213-S216 WeakPolarHBondContact O-CB 2.98Å; T213-S216 PolarHBondContact O-N 3.31Å; T213-S216 PolarHBondContact O-OG 3.15Å; T213-Y311 VanDerWaalsContact CG2-O 3.25Å; T213-Y311 WeakPolarHBondContact CG2-O 3.36Å; T213-Y311 PolarHBondContact OG1-O 2.9Å
214	L	98.5	Very high	96.5	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.1	-43.4	173.6	-179.9	51.3	0	0	0	112.2	I127 L131 F134 L151 I158 F192 F210 S216 A217 V218	I127-L214 HydrophobicContact CD1-CD1 4.28Å; I127-L214 HydrophobicContact CD1-CD2 3.63Å; I127-L214 HydrophobicContact CD1-CG 4.09Å; L131-L214 HydrophobicContact CD2-CD1 3.8Å; F134-L214 HydrophobicContact CD1-CD2 4.47Å; F134-L214 HydrophobicContact CD2-CD1 3.35Å; F134-L214 HydrophobicContact CD2-CD2 4.23Å; F134-L214 HydrophobicContact CD2-CG 4.44Å; F134-L214 HydrophobicContact CE1-CD2 3.95Å; F134-L214 HydrophobicContact CE2-CD1 3.51Å; F134-L214 HydrophobicContact CE2-CD2 3.69Å; F134-L214 HydrophobicContact CE2-CG 4.21Å; F134-L214 HydrophobicContact CG-CD1 3.93Å; F134-L214 HydrophobicContact CZ-CD1 4.21Å; F134-L214 HydrophobicContact CZ-CD2 3.53Å; L151-L214 HydrophobicContact CD1-CD2 4.4Å; L151-L214 HydrophobicContact CD1-CG 4.18Å; L151-L214 HydrophobicContact CD2-CD2 3.99Å; L151-L214 HydrophobicContact CD2-CG 4.45Å; I158-L214 HydrophobicContact CD1-CD2 4.32Å; I158-L214 HydrophobicContact CG1-CD2 4.49Å; F192-L214 HydrophobicContact CE2-CB 4.2Å; F192-L214 HydrophobicContact CZ-CB 3.96Å; F210-L214 PolarHBondContact O-N 2.89Å; L214-S216 PolarHBondContact O-N 3.3Å; L214-A217 WeakPolarHBondContact O-CB 3.12Å; L214-A217 PolarHBondContact O-N 3.32Å; L214-V218 HydrophobicContact CD1-CG2 4.49Å; L214-V218 PolarHBondContact O-N 3.23Å
215	L	98.5	Very high	96.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.6	-33.8	177.5	-176.3	56.8	0	0	0	112.3	T108 V112 V148 L151 L152 A211 F212 T213 V218 I219	T108-L215 HydrophobicContact CG2-CD2 3.68Å; T108-L215 HydrophobicContact CG2-CG 4.06Å; V112-L215 HydrophobicContact CG2-CD1 4.06Å; V112-L215 HydrophobicContact CG2-CD2 4.12Å; V112-L215 HydrophobicContact CG2-CG 4.37Å; V148-L215 HydrophobicContact CG1-CD1 3.76Å; V148-L215 HydrophobicContact CG2-CD1 4.26Å; L151-L215 HydrophobicContact CD1-CB 4.2Å; L151-L215 HydrophobicContact CD1-CD1 4.34Å; L152-L215 HydrophobicContact CD2-CD2 3.5Å; L152-L215 HydrophobicContact CG-CD2 3.78Å; A211-L215 WeakPolarHBondContact O-CB 3.45Å; A211-L215 PolarHBondContact O-N 3.26Å; F212-L215 HydrophobicContact CD1-CD2 4.38Å; F212-L215 HydrophobicContact CE1-CD2 4.43Å; F212-L215 PolarHBondContact O-N 2.97Å; T213-L215 PolarHBondContact O-N 3.08Å; L215-V218 PolarHBondContact O-N 3.12Å; L215-I219 HydrophobicContact CD1-CD1 4.32Å; L215-I219 HydrophobicContact CD1-CG1 4.36Å; L215-I219 HydrophobicContact CG-CD1 3.99Å; L215-I219 HydrophobicContact CG-CG1 4.49Å; L215-I219 VanDerWaalsContact O-CG1 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.43Å; L215-I219 PolarHBondContact O-N 2.74Å
216	S	98.1	Very high	96.8	Very high	4 Å²	4	21 Å²	21	3%	0.028	10%	0.103	C	C	.	.	H	α-helix	trans	-62.6	-42.1	175.2	76.3	0	0	0	0	112.5	T185 F212 T213 L214 I219 E220	T185-S216 VanDerWaalsContact CB-OG 3.3Å; T185-S216 WeakPolarHBondContact CB-OG 3.43Å; T185-S216 WeakPolarHBondContact CG2-OG 3.47Å; F212-S216 PolarHBondContact O-N 2.97Å; T213-S216 WeakPolarHBondContact O-CB 2.98Å; T213-S216 PolarHBondContact O-N 3.31Å; T213-S216 PolarHBondContact O-OG 3.15Å; L214-S216 PolarHBondContact O-N 3.3Å; S216-I219 PolarHBondContact O-N 3.48Å; S216-E220 WeakPolarHBondContact O-CG 3.45Å; S216-E220 PolarHBondContact O-N 3Å
217	A	97.6	Very high	96.8	Very high	2 Å²	2	20.8 Å²	20.8	2%	0.017	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-39.2	175.3	0	0	0	0	0	112.7	L131 T185 L214 E220 K221	L131-A217 HydrophobicContact CD2-CB 3.88Å; T185-A217 WeakPolarHBondContact OG1-CA 3.41Å; T185-A217 WeakPolarHBondContact OG1-CB 3.24Å; L214-A217 WeakPolarHBondContact O-CB 3.12Å; L214-A217 PolarHBondContact O-N 3.32Å; A217-E220 PolarHBondContact O-N 2.9Å; A217-K221 PolarHBondContact O-N 3.41Å; A217-K221 VanDerWaalsContact O-N 3.11Å
218	V	98.2	Very high	96.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-45.7	174	174.7	0	0	0	0	110.7	I127 Y130 L131 V148 L214 L215 E220 K221 I222	I127-V218 HydrophobicContact CB-CG2 4.01Å; I127-V218 HydrophobicContact CG2-CG2 4.18Å; Y130-V218 HydrophobicContact CD2-CG1 4.18Å; Y130-V218 HydrophobicContact CG-CG1 4.47Å; L131-V218 HydrophobicContact CB-CG2 4.34Å; L131-V218 HydrophobicContact CD2-CG2 4.07Å; V148-V218 HydrophobicContact CG2-CG1 4.07Å; L214-V218 HydrophobicContact CD1-CG2 4.49Å; L214-V218 PolarHBondContact O-N 3.23Å; L215-V218 PolarHBondContact O-N 3.12Å; V218-E220 PolarHBondContact O-N 3.17Å; V218-K221 PolarHBondContact O-N 3.19Å; V218-I222 HydrophobicContact CG1-CD1 3.81Å; V218-I222 HydrophobicContact CG1-CG1 4.48Å; V218-I222 VanDerWaalsContact O-CG1 3.29Å; V218-I222 WeakPolarHBondContact O-CG1 3.35Å; V218-I222 PolarHBondContact O-N 3.47Å
219	I	98	Very high	96.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.2	-42.1	178	-70.4	165.3	0	0	0	111.4	T108 L111 V112 L115 L215 S216 I222 C223 L229 F261	T108-I219 HydrophobicContact CG2-CD1 3.87Å; L111-I219 HydrophobicContact CB-CD1 4.37Å; V112-I219 HydrophobicContact CG2-CD1 3.88Å; V112-I219 HydrophobicContact CG2-CG1 4.32Å; L115-I219 HydrophobicContact CD1-CG1 4.14Å; L115-I219 HydrophobicContact CD1-CG2 4.4Å; L215-I219 HydrophobicContact CD1-CD1 4.32Å; L215-I219 HydrophobicContact CD1-CG1 4.36Å; L215-I219 HydrophobicContact CG-CD1 3.99Å; L215-I219 HydrophobicContact CG-CG1 4.49Å; L215-I219 VanDerWaalsContact O-CG1 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.43Å; L215-I219 PolarHBondContact O-N 2.74Å; S216-I219 PolarHBondContact O-N 3.48Å; I219-I222 PolarHBondContact O-N 3.41Å; I219-C223 PolarHBondContact O-N 3.07Å; I219-C223 PolarHBondContact O-SG 2.83Å; I219-L229 HydrophobicContact CG2-CD1 4.23Å; I219-F261 HydrophobicContact CB-CD2 4.19Å; I219-F261 HydrophobicContact CD1-CD2 4.31Å; I219-F261 HydrophobicContact CD1-CE2 3.8Å; I219-F261 HydrophobicContact CG2-CD2 4.05Å; I219-F261 HydrophobicContact CG2-CE2 4.48Å
220	E	96.4	Very high	96.3	Very high	12 Å²	12	19.3 Å²	19.3	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-46.8	177	-71.4	-170.6	151	0	0	111.9	T185 S216 A217 V218 C223 L224 L255 A259 R260 F261	T185-E220 VanDerWaalsContact CG2-CD 3.5Å; T185-E220 HydrophobicContact CG2-CG 4.34Å; T185-E220 WeakPolarHBondContact CG2-OE2 3.39Å; T185-E220 PolarHBondContact OG1-OE2 2.84Å; S216-E220 WeakPolarHBondContact O-CG 3.45Å; S216-E220 PolarHBondContact O-N 3Å; A217-E220 PolarHBondContact O-N 2.9Å; V218-E220 PolarHBondContact O-N 3.17Å; E220-C223 PolarHBondContact O-N 3.5Å; E220-L224 WeakPolarHBondContact O-CB 3.36Å; E220-L224 PolarHBondContact O-N 3.32Å; E220-L255 HydrophobicContact CB-CD1 4.22Å; E220-A259 WeakPolarHBondContact CA-O 3.36Å; E220-R260 WeakPolarHBondContact OE1-CA 3.32Å; E220-F261 HydrophobicContact CG-CB 3.67Å; E220-F261 WeakPolarHBondContact OE1-CB 3.41Å; E220-F261 PolarHBondContact OE1-N 3.04Å
221	K	96.8	Very high	95.3	Very high	48 Å²	48	26.2 Å²	26.2	21%	0.209	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-38.6	178.2	-76.4	-60.1	-165	167.5	0	113	Y130 L131 E133 A217 V218 C223 L224 N225	Y130-K221 VanDerWaalsContact O-CB 3.25Å; Y130-K221 WeakPolarHBondContact O-CB 3.28Å; L131-K221 HydrophobicContact CD1-CD 4.42Å; L131-K221 HydrophobicContact CD1-CG 3.49Å; L131-K221 VanDerWaalsContact CD1-CG 3.49Å; E133-K221 VanDerWaalsContact OE1-CE 3.23Å; E133-K221 WeakPolarHBondContact OE1-CE 3.28Å; E133-K221 IonicContact OE1-NZ 2.74Å; E133-K221 PolarHBondContact OE1-NZ 2.81Å; A217-K221 PolarHBondContact O-N 3.41Å; A217-K221 VanDerWaalsContact O-N 3.11Å; V218-K221 PolarHBondContact O-N 3.19Å; K221-C223 VanDerWaalsContact C-N 3.34Å; K221-L224 HydrophobicContact CD-CD2 4.27Å; K221-L224 PolarHBondContact O-N 2.67Å; K221-N225 WeakPolarHBondContact O-CB 3.41Å; K221-N225 VanDerWaalsContact O-CG 3.31Å; K221-N225 PolarHBondContact O-N 2.95Å; K221-N225 PolarHBondContact O-ND2 3.49Å
222	I	97.3	Very high	93.6	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-45	174.5	-68.1	169.1	0	0	0	110.3	L115 K120 L121 Y130 V218 I219 N225 K226	L115-I222 HydrophobicContact CD1-CB 4.33Å; L115-I222 HydrophobicContact CD1-CD1 4.17Å; L115-I222 HydrophobicContact CD1-CG2 3.99Å; L115-I222 HydrophobicContact CD2-CG2 3.78Å; L115-I222 HydrophobicContact CG-CG2 4.44Å; K120-I222 HydrophobicContact CB-CG2 3.99Å; L121-I222 HydrophobicContact CB-CD1 4.2Å; L121-I222 HydrophobicContact CD1-CD1 3.51Å; L121-I222 HydrophobicContact CG-CD1 4.16Å; Y130-I222 HydrophobicContact CD1-CD1 3.87Å; Y130-I222 HydrophobicContact CD1-CG1 3.48Å; Y130-I222 VanDerWaalsContact CD1-CG1 3.48Å; Y130-I222 HydrophobicContact CD2-CD1 4.09Å; Y130-I222 HydrophobicContact CD2-CG1 4.43Å; Y130-I222 HydrophobicContact CE1-CD1 4.16Å; Y130-I222 HydrophobicContact CE1-CG1 4.1Å; Y130-I222 HydrophobicContact CE2-CD1 4.4Å; Y130-I222 HydrophobicContact CG-CD1 3.83Å; Y130-I222 HydrophobicContact CG-CG1 3.67Å; V218-I222 HydrophobicContact CG1-CD1 3.81Å; V218-I222 HydrophobicContact CG1-CG1 4.48Å; V218-I222 VanDerWaalsContact O-CG1 3.29Å; V218-I222 WeakPolarHBondContact O-CG1 3.35Å; V218-I222 PolarHBondContact O-N 3.47Å; I219-I222 PolarHBondContact O-N 3.41Å; I222-N225 PolarHBondContact O-N 3.3Å; I222-K226 HydrophobicContact CG2-CD 4.38Å; I222-K226 WeakPolarHBondContact O-CA 3.29Å; I222-K226 WeakPolarHBondContact O-CB 3.45Å; I222-K226 PolarHBondContact O-N 3.43Å
223	C	95.8	Very high	91.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-49.2	176.6	-67.1	0	0	0	0	110.7	I219 E220 K221 N225 G227 W258 A259	I219-C223 PolarHBondContact O-N 3.07Å; I219-C223 PolarHBondContact O-SG 2.83Å; E220-C223 PolarHBondContact O-N 3.5Å; K221-C223 VanDerWaalsContact C-N 3.34Å; C223-N225 VanDerWaalsContact C-N 3.28Å; C223-N225 PolarHBondContact O-N 3.15Å; C223-G227 CarbonylContact O-C 3.58Å; C223-G227 VanDerWaalsContact O-CA 3.32Å; C223-G227 WeakPolarHBondContact O-CA 3.3Å; C223-G227 PolarHBondContact O-N 3.45Å; C223-W258 HydrophobicContact CB-CZ3 4.48Å; C223-W258 WeakPolarHBondContact O-CH2 3.45Å; C223-W258 WeakPolarHBondContact O-CZ3 3.41Å; C223-A259 HydrophobicContact CB-CB 4.14Å
224	L	95	Very high	89.5	Confident	61 Å²	61	41.8 Å²	41.8	32%	0.319	22%	0.224	S	C	.	.	H	α-helix	trans	-52.8	-46.1	178.2	-178.9	67.8	0	0	0	112.1	E220 K221 L255 P256 A259	E220-L224 WeakPolarHBondContact O-CB 3.36Å; E220-L224 PolarHBondContact O-N 3.32Å; K221-L224 HydrophobicContact CD-CD2 4.27Å; K221-L224 PolarHBondContact O-N 2.67Å; L224-L255 HydrophobicContact CB-CD2 4.25Å; L224-L255 HydrophobicContact CD1-CD2 3.94Å; L224-L255 HydrophobicContact CD2-CD2 3.7Å; L224-L255 HydrophobicContact CG-CD2 4.18Å; L224-P256 HydrophobicContact CD1-CG 4.17Å; L224-A259 HydrophobicContact CB-CB 4.37Å
225	N	96	Very high	87.3	Confident	110 Å²	110	44.3 Å²	44.3	59%	0.588	25%	0.245	S	C	*	.	H	α-helix	trans	-87.5	-28.9	-171.8	-65.6	-17.4	0	0	0	113.9	K221 I222 C223	K221-N225 WeakPolarHBondContact O-CB 3.41Å; K221-N225 VanDerWaalsContact O-CG 3.31Å; K221-N225 PolarHBondContact O-N 2.95Å; K221-N225 PolarHBondContact O-ND2 3.49Å; I222-N225 PolarHBondContact O-N 3.3Å; C223-N225 VanDerWaalsContact C-N 3.28Å; C223-N225 PolarHBondContact O-N 3.15Å
226	K	95.8	Very high	84.7	Confident	99 Å²	99	49.6 Å²	49.6	43%	0.43	28%	0.278	S	S	.	.	H	α-helix	trans	-118	8.1	-172.9	-57.9	-169.9	179.2	-175.9	0	113.8	K120 I222	K120-K226 HydrophobicContact CB-CB 4.23Å; K120-K226 HydrophobicContact CB-CD 3.93Å; K120-K226 HydrophobicContact CD-CB 3.99Å; K120-K226 WeakPolarHBondContact CE-O 3.39Å; K120-K226 HydrophobicContact CG-CB 3.96Å; K120-K226 HydrophobicContact CG-CD 4.32Å; K120-K226 PolarHBondContact NZ-O 2.92Å; K120-K226 WeakPolarHBondContact O-CD 3.15Å; K120-K226 WeakPolarHBondContact O-CE 3.46Å; K120-K226 PolarHBondContact O-NZ 2.89Å; I222-K226 HydrophobicContact CG2-CD 4.38Å; I222-K226 WeakPolarHBondContact O-CA 3.29Å; I222-K226 WeakPolarHBondContact O-CB 3.45Å; I222-K226 PolarHBondContact O-N 3.43Å
227	G	92.8	Very high	82	Confident	26 Å²	26	53.1 Å²	53.1	27%	0.268	30%	0.299	S	S	.	.			trans	85.2	169.7	176	0	0	0	0	0	114.2	K120 C223	K120-G227 PolarHBondContact NZ-O 3.06Å; C223-G227 CarbonylContact O-C 3.58Å; C223-G227 VanDerWaalsContact O-CA 3.32Å; C223-G227 WeakPolarHBondContact O-CA 3.3Å; C223-G227 PolarHBondContact O-N 3.45Å
228	S	90.8	Very high	79	Confident	29 Å²	29	63.4 Å²	63.4	20%	0.203	34%	0.343	C	S	.	.			trans	-60.4	147.3	-169.4	-162.1	0	0	0	0	114.6	K120 F230 R267	K120-S228 PolarHBondContact NZ-O 3.37Å; S228-F230 VanDerWaalsContact C-N 3.33Å; S228-F230 PolarHBondContact OG-O 3.27Å; S228-R267 PolarHBondContact OG-NH1 3.04Å
229	L	92.2	Very high	76.1	Confident	0 Å²	0	67 Å²	67	0%	0	38%	0.38	C	S	.	.	S	Bend	trans	-69.1	-29.1	173.3	-94.8	165	0	0	0	113.4	L111 R114 L115 Q118 I219 N264	L111-L229 HydrophobicContact CB-CD1 4.35Å; L111-L229 HydrophobicContact CD2-CD1 4.22Å; R114-L229 HydrophobicContact CB-CD2 3.86Å; R114-L229 HydrophobicContact CG-CD2 3.85Å; R114-L229 PolarHBondContact NE-O 2.94Å; L115-L229 HydrophobicContact CD2-CD1 4.36Å; L115-L229 HydrophobicContact CD2-CD2 3.49Å; L115-L229 VanDerWaalsContact CD2-CD2 3.49Å; L115-L229 HydrophobicContact CD2-CG 3.78Å; L115-L229 HydrophobicContact CG-CD2 3.75Å; L115-L229 HydrophobicContact CG-CG 4.34Å; Q118-L229 PolarHBondContact NE2-O 3.12Å; I219-L229 HydrophobicContact CG2-CD1 4.23Å; L229-N264 WeakPolarHBondContact CB-OD1 3.46Å; L229-N264 HydrophobicContact CD1-CB 4.01Å
230	F	91.1	Very high	73.1	Confident	14 Å²	14	73.8 Å²	73.8	6%	0.061	41%	0.412	C	S	.	.			trans	-125.6	129.9	-175.7	-60.5	-91.4	0	0	0	109.7	L111 S228 Q232 N264 R267 L268 Y271 I345	L111-F230 HydrophobicContact CD2-CE2 4.14Å; L111-F230 HydrophobicContact CD2-CZ 4.19Å; S228-F230 VanDerWaalsContact C-N 3.33Å; S228-F230 PolarHBondContact OG-O 3.27Å; F230-Q232 VanDerWaalsContact C-N 3.35Å; F230-N264 WeakPolarHBondContact CE2-O 3.26Å; F230-R267 HydrophobicContact CD1-CB 4.4Å; F230-R267 HydrophobicContact CD2-CB 3.5Å; F230-R267 VanDerWaalsContact CD2-CB 3.5Å; F230-R267 HydrophobicContact CD2-CG 4.28Å; F230-R267 HydrophobicContact CE2-CB 3.64Å; F230-R267 HydrophobicContact CG-CB 3.91Å; F230-R267 HydrophobicContact CZ-CB 4.17Å; F230-L268 HydrophobicContact CZ-CB 3.97Å; F230-L268 HydrophobicContact CZ-CD1 4.46Å; F230-Y271 HydrophobicContact CD1-CD2 4.46Å; F230-Y271 HydrophobicContact CE1-CD2 4.37Å; F230-Y271 HydrophobicContact CE1-CG 4.33Å; F230-I345 HydrophobicContact CE1-CD1 3.88Å; F230-I345 HydrophobicContact CZ-CD1 4.3Å
231	D	78	Confident	69.8	Low	145 Å²	145	77.3 Å²	77.3	78%	0.775	44%	0.438	S	S	*	.	S	Bend	trans	-74.4	-27.1	-175.9	-54.6	-49.6	0	0	0	112.6
232	Q	61.9	Low	66.7	Low	160 Å²	160	85.4 Å²	85.4	75%	0.748	47%	0.473	S	S	*	.	S	Bend	trans	-83	135.7	-179.2	-64.1	-131.7	-5.7	0	0	111.6	F230	F230-Q232 VanDerWaalsContact C-N 3.35Å
233	P	55.8	Low	63.4	Low	104 Å²	104	90 Å²	90	68%	0.675	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-60.4	150.1	167.6	24.6	-29.8	0	0	0	110	A235	P233-A235 PolarHBondContact O-N 3.06Å
234	L	54.6	Low	60.2	Low	62 Å²	62	94.1 Å²	94.1	33%	0.325	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-54.1	127.9	174.6	-91.6	107.6	0	0	0	108.7	T236 T263 R267	L234-T236 PolarHBondContact O-N 3.01Å; L234-T263 HydrophobicContact CD1-CG2 3.66Å; L234-R267 HydrophobicContact CD1-CG 4.02Å; L234-R267 VanDerWaalsContact CD1-NE 3.26Å; L234-R267 HydrophobicContact CG-CG 4.04Å
235	A	52.8	Low	56.9	Low	54 Å²	54	98.1 Å²	98.1	45%	0.446	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-64.5	126.4	159.4	0	0	0	0	0	105.7	P233 V237	P233-A235 PolarHBondContact O-N 3.06Å; A235-V237 PolarHBondContact O-N 3.21Å
236	T	44.8	Very low	53.8	Low	110 Å²	110	100.3 Å²	100.3	68%	0.675	57%	0.572	S	S	*	*			trans	-49.4	114	176.5	-32.7	0	0	0	0	108.3	L234 K238	L234-T236 PolarHBondContact O-N 3.01Å; T236-K238 PolarHBondContact O-N 2.78Å
237	V	40.7	Very low	50.6	Low	79 Å²	79	105.3 Å²	105.3	48%	0.479	59%	0.594	S	S	.	*			trans	-58.4	124.8	180	177.5	0	0	0	0	107.1	A235 G239 E240	A235-V237 PolarHBondContact O-N 3.21Å; V237-G239 PolarHBondContact O-N 2.93Å; V237-E240 PolarHBondContact O-N 3.37Å
238	K	35	Very low	47.8	Very low	217 Å²	217	111.9 Å²	111.9	94%	0.943	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	104.4	171	-84.5	-177.1	174.8	177.9	0	107.8	T236	T236-K238 PolarHBondContact O-N 2.78Å
239	G	35.6	Very low	45	Very low	75 Å²	75	116.6 Å²	116.6	77%	0.773	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.4	-15.9	-179.3	0	0	0	0	0	114.7	V237 S241	V237-G239 PolarHBondContact O-N 2.93Å; G239-S241 VanDerWaalsContact C-N 3.33Å; G239-S241 PolarHBondContact O-N 3.37Å
240	E	36.4	Very low	42	Very low	143 Å²	143	126.3 Å²	126.3	67%	0.668	69%	0.688	S	S	*	*			trans	-74.9	91.5	165.8	-73.5	-171.7	164.3	0	0	108.8	V237 K242	V237-E240 PolarHBondContact O-N 3.37Å; E240-K242 PolarHBondContact O-N 3.02Å
241	S	26.8	Very low	39.5	Very low	87 Å²	87	127.9 Å²	127.9	61%	0.608	70%	0.701	S	S	*	*			trans	-57.3	127.9	163.4	52.4	0	0	0	0	108	G239 S243	G239-S241 VanDerWaalsContact C-N 3.33Å; G239-S241 PolarHBondContact O-N 3.37Å; S241-S243 PolarHBondContact O-N 3.05Å
242	K	31	Very low	37.9	Very low	217 Å²	217	126.1 Å²	126.1	94%	0.943	70%	0.695	S	S	*	*	S	Bend	trans	-67.3	31.1	167.7	-75.1	-174.3	171.8	-178.3	0	112.3	E240	E240-K242 PolarHBondContact O-N 3.02Å
243	S	28.5	Very low	37.6	Very low	98 Å²	98	122 Å²	122	69%	0.685	68%	0.678	S	S	*	*			trans	-148.1	65.9	-165.4	171.4	0	0	0	0	110.7	S241	S241-S243 PolarHBondContact O-N 3.05Å
244	S	28.2	Very low	38.3	Very low	86 Å²	86	125.1 Å²	125.1	60%	0.601	69%	0.689	S	S	*	*			trans	-133.7	108.8	136.6	52.2	0	0	0	0	107.1	E246	S244-E246 PolarHBondContact O-N 3.05Å
245	C	25.7	Very low	39.8	Very low	145 Å²	145	124 Å²	124	98%	0.98	68%	0.683	S	S	*	*			trans	-72.6	76.2	167.6	-151.1	0	0	0	0	106.5
246	E	32.3	Very low	41.7	Very low	157 Å²	157	123.5 Å²	123.5	73%	0.734	68%	0.676	S	S	*	*			trans	-112.6	118.2	174.2	-77.8	-178.3	175.2	0	0	108	S244 E248	S244-E246 PolarHBondContact O-N 3.05Å; E246-E248 PolarHBondContact O-N 3.2Å
247	K	27.6	Very low	43.8	Very low	204 Å²	204	125.1 Å²	125.1	89%	0.887	67%	0.673	S	S	*	*			trans	-47.2	105.7	169.6	-68.7	172.2	177.3	175.6	0	107.1	T249	K247-T249 PolarHBondContact O-N 3.38Å
248	E	33.9	Very low	46.2	Very low	164 Å²	164	125.4 Å²	125.4	77%	0.766	67%	0.666	S	S	*	*			trans	-52.6	107.2	167.9	-77.7	-178.6	156.2	0	0	106.1	E246 K250	E246-E248 PolarHBondContact O-N 3.2Å; E248-K250 PolarHBondContact O-N 3.33Å
249	T	32.6	Very low	49	Very low	128 Å²	128	115.1 Å²	115.1	79%	0.785	62%	0.621	S	S	*	*			trans	-51.1	118.1	164.9	38.8	0	0	0	0	105.9	K247 S251	K247-T249 PolarHBondContact O-N 3.38Å; T249-S251 VanDerWaalsContact C-N 3.26Å; T249-S251 PolarHBondContact O-N 3.41Å
250	K	29.7	Very low	51.8	Low	204 Å²	204	115.6 Å²	115.6	89%	0.887	60%	0.6	S	S	*	*			trans	-47.2	92.5	176.8	-73.1	-179.9	174.2	-177.3	0	109.2	E248	E248-K250 PolarHBondContact O-N 3.33Å
251	S	38.4	Very low	54.6	Low	47 Å²	47	108.9 Å²	108.9	33%	0.329	57%	0.568	S	S	.	*			trans	-75.6	120.2	170.1	169.7	0	0	0	0	105.8	T249 N253	T249-S251 VanDerWaalsContact C-N 3.26Å; T249-S251 PolarHBondContact O-N 3.41Å; S251-N253 PolarHBondContact O-N 2.81Å
252	T	43.9	Very low	57.9	Low	107 Å²	107	105.2 Å²	105.2	66%	0.656	54%	0.542	S	S	*	.	S	Bend	trans	-74.6	25	-168.6	46	0	0	0	0	114.5
253	N	55.9	Low	60.9	Low	75 Å²	75	95.5 Å²	95.5	40%	0.401	50%	0.501	S	S	.	.			trans	-143.5	99.5	168.4	-85.1	-38.1	0	0	0	108.9	D184 S251 L255	D184-N253 PolarHBondContact OD2-ND2 3.34Å; S251-N253 PolarHBondContact O-N 2.81Å; N253-L255 PolarHBondContact O-N 2.86Å
254	D	70.7	Confident	64.1	Low	168 Å²	168	90.9 Å²	90.9	90%	0.898	47%	0.468	S	S	*	.			trans	-69.3	53.8	177.6	-74.4	-36.9	0	0	0	112.1
255	L	86.3	Confident	67.3	Low	38 Å²	38	86.8 Å²	86.8	20%	0.199	44%	0.44	C	S	.	.			trans	-70.9	126.7	170.7	-74.5	174.1	0	0	0	108.9	E220 L224 N253 K257 R260	E220-L255 HydrophobicContact CB-CD1 4.22Å; L224-L255 HydrophobicContact CB-CD2 4.25Å; L224-L255 HydrophobicContact CD1-CD2 3.94Å; L224-L255 HydrophobicContact CD2-CD2 3.7Å; L224-L255 HydrophobicContact CG-CD2 4.18Å; N253-L255 PolarHBondContact O-N 2.86Å; L255-K257 PolarHBondContact O-N 3.24Å; L255-R260 HydrophobicContact CB-CG 4.06Å
256	P	91.1	Very high	70.6	Confident	45 Å²	45	82.7 Å²	82.7	29%	0.292	41%	0.408	S	S	.	.			trans	-61.9	142.1	175	28.4	-34.6	0	0	0	109.5	L224 W258 A259	L224-P256 HydrophobicContact CD1-CG 4.17Å; P256-W258 HydrophobicContact CB-CG 4.47Å; P256-W258 HydrophobicContact CB-CZ2 4.42Å; P256-W258 HydrophobicContact CG-CD2 4.29Å; P256-W258 HydrophobicContact CG-CH2 4.47Å; P256-W258 HydrophobicContact CG-CZ2 3.63Å; P256-W258 PolarHBondContact O-N 2.73Å; P256-A259 HydrophobicContact CG-CB 3.98Å; P256-A259 WeakPolarHBondContact O-CB 3.46Å; P256-A259 PolarHBondContact O-N 3.31Å
257	K	90.4	Very high	73.6	Confident	143 Å²	143	76.4 Å²	76.4	62%	0.622	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-48.2	-41.1	-173.1	-71.6	-173.8	178.2	-178.1	0	113.4	L255 A259 R260 T263	L255-K257 PolarHBondContact O-N 3.24Å; K257-A259 PolarHBondContact O-N 3Å; K257-R260 PolarHBondContact O-N 2.78Å; K257-T263 WeakPolarHBondContact O-CB 3.23Å; K257-T263 VanDerWaalsContact O-CG2 3.24Å; K257-T263 WeakPolarHBondContact O-CG2 3.26Å; K257-T263 PolarHBondContact O-OG1 3.2Å; K257-T263 VanDerWaalsContact O-OG1 3.06Å
258	W	90.6	Very high	76.9	Confident	86 Å²	86	66.7 Å²	66.7	33%	0.326	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-64.9	-18.3	-179.2	63.5	-102.8	0	0	0	114.8	C223 P256 N264	C223-W258 HydrophobicContact CB-CZ3 4.48Å; C223-W258 WeakPolarHBondContact O-CH2 3.45Å; C223-W258 WeakPolarHBondContact O-CZ3 3.41Å; P256-W258 HydrophobicContact CB-CG 4.47Å; P256-W258 HydrophobicContact CB-CZ2 4.42Å; P256-W258 HydrophobicContact CG-CD2 4.29Å; P256-W258 HydrophobicContact CG-CH2 4.47Å; P256-W258 HydrophobicContact CG-CZ2 3.63Å; P256-W258 PolarHBondContact O-N 2.73Å; W258-N264 PolarHBondContact O-ND2 2.94Å
259	A	93.8	Very high	79.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-93.1	-19.3	177.8	0	0	0	0	0	113.1	E220 C223 L224 P256 K257	E220-A259 WeakPolarHBondContact CA-O 3.36Å; C223-A259 HydrophobicContact CB-CB 4.14Å; L224-A259 HydrophobicContact CB-CB 4.37Å; P256-A259 HydrophobicContact CG-CB 3.98Å; P256-A259 WeakPolarHBondContact O-CB 3.46Å; P256-A259 PolarHBondContact O-N 3.31Å; K257-A259 PolarHBondContact O-N 3Å
260	R	94.5	Very high	82.9	Confident	85 Å²	85	57.4 Å²	57.4	32%	0.321	28%	0.283	S	S	.	.	S	Bend	trans	-67.1	145.6	-177.8	-65.3	169.5	50.8	155.1	-5.3	112.1	E220 L255 K257 D262 T263 N264	E220-R260 WeakPolarHBondContact OE1-CA 3.32Å; L255-R260 HydrophobicContact CB-CG 4.06Å; K257-R260 PolarHBondContact O-N 2.78Å; R260-D262 WeakPolarHBondContact CB-OD1 3.34Å; R260-D262 IonicContact CZ-OD1 3.58Å; R260-D262 IonicContact CZ-OD2 2.67Å; R260-D262 IonicContact NE-OD1 3.97Å; R260-D262 PolarHBondContact NE-OD1 3.03Å; R260-D262 IonicContact NE-OD2 3.75Å; R260-D262 IonicContact NH2-OD1 2.8Å; R260-D262 IonicContact NH2-OD2 3.71Å; R260-D262 PolarHBondContact NH2-OD2 2.77Å; R260-T263 PolarHBondContact O-N 2.85Å; R260-N264 PolarHBondContact O-N 2.88Å; R260-N264 VanDerWaalsContact O-N 3.1Å; R260-N264 PolarHBondContact O-ND2 3.25Å
261	F	95.8	Very high	85.9	Confident	3 Å²	3	51.9 Å²	51.9	1%	0.013	26%	0.257	C	S	.	.	H	α-helix	trans	-65.6	-43.7	-176.5	-177.6	-102.8	0	0	0	111.5	T108 L111 T185 I219 E220 T263 N264 L265 W313 A314	T108-F261 HydrophobicContact CG2-CE2 4.16Å; T108-F261 HydrophobicContact CG2-CZ 4.09Å; L111-F261 HydrophobicContact CD1-CD2 4.35Å; L111-F261 HydrophobicContact CD1-CE2 3.78Å; L111-F261 HydrophobicContact CD1-CZ 4.32Å; T185-F261 HydrophobicContact CG2-CB 4.02Å; I219-F261 HydrophobicContact CB-CD2 4.19Å; I219-F261 HydrophobicContact CD1-CD2 4.31Å; I219-F261 HydrophobicContact CD1-CE2 3.8Å; I219-F261 HydrophobicContact CG2-CD2 4.05Å; I219-F261 HydrophobicContact CG2-CE2 4.48Å; E220-F261 HydrophobicContact CG-CB 3.67Å; E220-F261 WeakPolarHBondContact OE1-CB 3.41Å; E220-F261 PolarHBondContact OE1-N 3.04Å; F261-T263 VanDerWaalsContact C-N 3.3Å; F261-T263 PolarHBondContact O-N 3.48Å; F261-N264 PolarHBondContact O-N 2.89Å; F261-N264 VanDerWaalsContact O-N 3.16Å; F261-L265 HydrophobicContact CD1-CD1 3.97Å; F261-L265 HydrophobicContact CD1-CG 4.41Å; F261-L265 HydrophobicContact CE1-CD1 3.32Å; F261-L265 HydrophobicContact CE1-CG 3.88Å; F261-L265 HydrophobicContact CZ-CD1 3.84Å; F261-L265 HydrophobicContact CZ-CD2 4.37Å; F261-L265 HydrophobicContact CZ-CG 4.01Å; F261-L265 PolarHBondContact O-N 2.98Å; F261-W313 HydrophobicContact CE1-CB 4.38Å; F261-A314 HydrophobicContact CE1-CB 3.52Å; F261-A314 HydrophobicContact CE2-CB 4.35Å; F261-A314 HydrophobicContact CZ-CB 3.41Å; F261-A314 VanDerWaalsContact CZ-CB 3.41Å
262	D	94.2	Very high	88.6	Confident	9 Å²	9	50.1 Å²	50.1	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-58	-43.9	177	63.6	-15.2	0	0	0	112	R260 N264 L265 L266 L279 Y281 W313	R260-D262 WeakPolarHBondContact CB-OD1 3.34Å; R260-D262 IonicContact CZ-OD1 3.58Å; R260-D262 IonicContact CZ-OD2 2.67Å; R260-D262 IonicContact NE-OD1 3.97Å; R260-D262 PolarHBondContact NE-OD1 3.03Å; R260-D262 IonicContact NE-OD2 3.75Å; R260-D262 IonicContact NH2-OD1 2.8Å; R260-D262 IonicContact NH2-OD2 3.71Å; R260-D262 PolarHBondContact NH2-OD2 2.77Å; D262-N264 VanDerWaalsContact C-N 3.34Å; D262-N264 PolarHBondContact O-N 3.01Å; D262-L265 PolarHBondContact O-N 2.81Å; D262-L266 WeakPolarHBondContact O-CG 3.06Å; D262-L266 PolarHBondContact O-N 2.95Å; D262-L279 HydrophobicContact CB-CD1 3.5Å; D262-L279 VanDerWaalsContact CB-CD1 3.5Å; D262-Y281 PolarHBondContact OD2-OH 2.88Å; D262-W313 HydrophobicContact CB-CE3 3.91Å; D262-W313 HydrophobicContact CB-CH2 4.37Å; D262-W313 HydrophobicContact CB-CZ3 3.6Å
263	T	94.2	Very high	91.1	Very high	14 Å²	14	49.8 Å²	49.8	9%	0.086	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-38.2	178	-59.2	0	0	0	0	111.6	L234 K257 R260 F261 L266 R267	L234-T263 HydrophobicContact CD1-CG2 3.66Å; K257-T263 WeakPolarHBondContact O-CB 3.23Å; K257-T263 VanDerWaalsContact O-CG2 3.24Å; K257-T263 WeakPolarHBondContact O-CG2 3.26Å; K257-T263 PolarHBondContact O-OG1 3.2Å; K257-T263 VanDerWaalsContact O-OG1 3.06Å; R260-T263 PolarHBondContact O-N 2.85Å; F261-T263 VanDerWaalsContact C-N 3.3Å; F261-T263 PolarHBondContact O-N 3.48Å; T263-L266 PolarHBondContact O-N 3.17Å; T263-R267 VanDerWaalsContact O-CG 3.31Å; T263-R267 WeakPolarHBondContact O-CG 3.49Å; T263-R267 PolarHBondContact O-N 2.97Å
264	N	95.8	Very high	93	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70	-33.8	176.2	-75.3	-64.4	0	0	0	112.8	L111 L229 F230 W258 R260 F261 D262 R267 L268	L111-N264 HydrophobicContact CD1-CB 4.31Å; L229-N264 WeakPolarHBondContact CB-OD1 3.46Å; L229-N264 HydrophobicContact CD1-CB 4.01Å; F230-N264 WeakPolarHBondContact CE2-O 3.26Å; W258-N264 PolarHBondContact O-ND2 2.94Å; R260-N264 PolarHBondContact O-N 2.88Å; R260-N264 VanDerWaalsContact O-N 3.1Å; R260-N264 PolarHBondContact O-ND2 3.25Å; F261-N264 PolarHBondContact O-N 2.89Å; F261-N264 VanDerWaalsContact O-N 3.16Å; D262-N264 VanDerWaalsContact C-N 3.34Å; D262-N264 PolarHBondContact O-N 3.01Å; N264-R267 PolarHBondContact O-N 3.45Å; N264-L268 PolarHBondContact O-N 3.39Å
265	L	96.5	Very high	94.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.4	-45.7	169.3	-80.3	178.7	0	0	0	112.1	F107 L111 F261 D262 R267 L268 F269 L279 W313 I318	F107-L265 HydrophobicContact CB-CD2 3.93Å; L111-L265 HydrophobicContact CD1-CD2 3.93Å; L111-L265 HydrophobicContact CD1-CG 4.18Å; F261-L265 HydrophobicContact CD1-CD1 3.97Å; F261-L265 HydrophobicContact CD1-CG 4.41Å; F261-L265 HydrophobicContact CE1-CD1 3.32Å; F261-L265 HydrophobicContact CE1-CG 3.88Å; F261-L265 HydrophobicContact CZ-CD1 3.84Å; F261-L265 HydrophobicContact CZ-CD2 4.37Å; F261-L265 HydrophobicContact CZ-CG 4.01Å; F261-L265 PolarHBondContact O-N 2.98Å; D262-L265 PolarHBondContact O-N 2.81Å; L265-R267 VanDerWaalsContact C-N 3.27Å; L265-R267 PolarHBondContact O-N 3.37Å; L265-L268 HydrophobicContact CD2-CD2 4.49Å; L265-L268 WeakPolarHBondContact O-CB 3.31Å; L265-L268 PolarHBondContact O-N 2.73Å; L265-L268 VanDerWaalsContact O-N 3.1Å; L265-F269 HydrophobicContact CB-CE1 4.4Å; L265-F269 HydrophobicContact CB-CE2 4.42Å; L265-F269 HydrophobicContact CB-CZ 3.99Å; L265-F269 HydrophobicContact CD2-CE1 4.32Å; L265-F269 HydrophobicContact CD2-CZ 4.42Å; L265-F269 VanDerWaalsContact O-CD1 3.26Å; L265-F269 WeakPolarHBondContact O-CD1 3.46Å; L265-F269 VanDerWaalsContact O-CG 3.23Å; L265-F269 WeakPolarHBondContact O-CG 3.34Å; L265-F269 PolarHBondContact O-N 2.79Å; L265-L279 HydrophobicContact CB-CD2 4.17Å; L265-L279 HydrophobicContact CD1-CD2 3.65Å; L265-W313 HydrophobicContact CD1-CB 4.17Å; L265-I318 HydrophobicContact CD1-CD1 4.39Å; L265-I318 HydrophobicContact CD2-CD1 4.39Å
266	L	95.5	Very high	94.6	Very high	60 Å²	60	44.2 Å²	44.2	31%	0.314	21%	0.208	S	C	.	.	H	α-helix	trans	-60.6	-38.1	177.5	-67.4	175.6	0	0	0	112.1	D262 T263 F269 Q270 L279	D262-L266 WeakPolarHBondContact O-CG 3.06Å; D262-L266 PolarHBondContact O-N 2.95Å; T263-L266 PolarHBondContact O-N 3.17Å; L266-F269 HydrophobicContact CD2-CD2 4.06Å; L266-F269 HydrophobicContact CD2-CE2 4.21Å; L266-F269 PolarHBondContact O-N 3.26Å; L266-Q270 PolarHBondContact O-N 3.15Å; L266-L279 HydrophobicContact CD2-CD1 4.5Å; L266-L279 HydrophobicContact CD2-CG 4.32Å; L266-L279 HydrophobicContact CG-CD1 4.39Å
267	R	94.5	Very high	95	Very high	24 Å²	24	42.5 Å²	42.5	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-37.7	174	-73.1	171.6	173.5	-159.5	-2.4	112.7	S228 F230 L234 T263 N264 L265 Q270 Y271	S228-R267 PolarHBondContact OG-NH1 3.04Å; F230-R267 HydrophobicContact CD1-CB 4.4Å; F230-R267 HydrophobicContact CD2-CB 3.5Å; F230-R267 VanDerWaalsContact CD2-CB 3.5Å; F230-R267 HydrophobicContact CD2-CG 4.28Å; F230-R267 HydrophobicContact CE2-CB 3.64Å; F230-R267 HydrophobicContact CG-CB 3.91Å; F230-R267 HydrophobicContact CZ-CB 4.17Å; L234-R267 HydrophobicContact CD1-CG 4.02Å; L234-R267 VanDerWaalsContact CD1-NE 3.26Å; L234-R267 HydrophobicContact CG-CG 4.04Å; T263-R267 VanDerWaalsContact O-CG 3.31Å; T263-R267 WeakPolarHBondContact O-CG 3.49Å; T263-R267 PolarHBondContact O-N 2.97Å; N264-R267 PolarHBondContact O-N 3.45Å; L265-R267 VanDerWaalsContact C-N 3.27Å; L265-R267 PolarHBondContact O-N 3.37Å; R267-Q270 PolarHBondContact O-N 3.17Å; R267-Y271 WeakPolarHBondContact O-CB 3.33Å; R267-Y271 PolarHBondContact O-N 3.1Å
268	L	96.5	Very high	95.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-44.6	172.5	177.4	62.3	0	0	0	111.1	F107 L110 L111 F230 N264 L265 Q270 Y271 L272 I345	F107-L268 HydrophobicContact CB-CD2 4Å; F107-L268 HydrophobicContact CD1-CD2 3.87Å; F107-L268 HydrophobicContact CD1-CG 4.46Å; F107-L268 HydrophobicContact CG-CD2 4.44Å; F107-L268 WeakPolarHBondContact O-CD2 3.39Å; L110-L268 HydrophobicContact CB-CD2 4.34Å; L111-L268 HydrophobicContact CD2-CB 4.01Å; L111-L268 HydrophobicContact CD2-CD2 3.94Å; L111-L268 HydrophobicContact CD2-CG 4.44Å; L111-L268 HydrophobicContact CG-CD2 4.2Å; F230-L268 HydrophobicContact CZ-CB 3.97Å; F230-L268 HydrophobicContact CZ-CD1 4.46Å; N264-L268 PolarHBondContact O-N 3.39Å; L265-L268 HydrophobicContact CD2-CD2 4.49Å; L265-L268 WeakPolarHBondContact O-CB 3.31Å; L265-L268 PolarHBondContact O-N 2.73Å; L265-L268 VanDerWaalsContact O-N 3.1Å; L268-Q270 VanDerWaalsContact C-N 3.33Å; L268-Q270 PolarHBondContact O-N 3.17Å; L268-Y271 PolarHBondContact O-N 3.17Å; L268-L272 HydrophobicContact CD1-CD1 3.72Å; L268-L272 HydrophobicContact CD1-CG 4.12Å; L268-L272 HydrophobicContact CG-CD1 3.99Å; L268-L272 WeakPolarHBondContact O-CB 3.47Å; L268-L272 WeakPolarHBondContact O-CG 3.46Å; L268-L272 PolarHBondContact O-N 2.93Å; L268-I345 HydrophobicContact CD1-CD1 3.59Å; L268-I345 HydrophobicContact CD1-CG1 3.62Å
269	F	97.1	Very high	95.6	Very high	5 Å²	5	33.2 Å²	33.2	2%	0.022	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-44.1	177	-54.5	-19.5	0	0	0	111.3	F107 L265 L266 L272 N273 L274 T277 L279 I318	F107-F269 AromaticContact CD1-CD1 3.92Å; F107-F269 HydrophobicContact CD1-CD1 3.92Å; F107-F269 AromaticContact CD1-CE1 3.51Å; F107-F269 HydrophobicContact CD1-CE1 3.51Å; F107-F269 AromaticContact CE1-CD1 3.82Å; F107-F269 HydrophobicContact CE1-CD1 3.82Å; F107-F269 AromaticContact CE1-CE1 3.67Å; F107-F269 HydrophobicContact CE1-CE1 3.67Å; F107-F269 HydrophobicContact CG-CE1 4.23Å; L265-F269 HydrophobicContact CB-CE1 4.4Å; L265-F269 HydrophobicContact CB-CE2 4.42Å; L265-F269 HydrophobicContact CB-CZ 3.99Å; L265-F269 HydrophobicContact CD2-CE1 4.32Å; L265-F269 HydrophobicContact CD2-CZ 4.42Å; L265-F269 VanDerWaalsContact O-CD1 3.26Å; L265-F269 WeakPolarHBondContact O-CD1 3.46Å; L265-F269 VanDerWaalsContact O-CG 3.23Å; L265-F269 WeakPolarHBondContact O-CG 3.34Å; L265-F269 PolarHBondContact O-N 2.79Å; L266-F269 HydrophobicContact CD2-CD2 4.06Å; L266-F269 HydrophobicContact CD2-CE2 4.21Å; L266-F269 PolarHBondContact O-N 3.26Å; F269-L272 CarbonylContact O-C 3.59Å; F269-L272 PolarHBondContact O-N 3.1Å; F269-N273 PolarHBondContact O-N 3.12Å; F269-N273 VanDerWaalsContact O-N 3.09Å; F269-L274 HydrophobicContact CB-CB 4.21Å; F269-L274 HydrophobicContact CB-CD1 4.46Å; F269-L274 HydrophobicContact CD1-CD1 4.13Å; F269-L274 PolarHBondContact O-N 3.3Å; F269-T277 HydrophobicContact CD1-CG2 3.84Å; F269-T277 HydrophobicContact CD2-CG2 3.96Å; F269-T277 WeakPolarHBondContact CD2-O 3.27Å; F269-T277 HydrophobicContact CE1-CG2 3.78Å; F269-T277 HydrophobicContact CE2-CG2 3.91Å; F269-T277 HydrophobicContact CG-CG2 3.95Å; F269-T277 HydrophobicContact CZ-CG2 3.83Å; F269-L279 HydrophobicContact CE2-CD2 4.03Å; F269-L279 HydrophobicContact CE2-CG 4.36Å; F269-L279 HydrophobicContact CZ-CD2 4.07Å; F269-I318 HydrophobicContact CE1-CD1 4.04Å; F269-I318 HydrophobicContact CZ-CD1 3.74Å; F269-I318 HydrophobicContact CZ-CG1 4.11Å; F269-I318 HydrophobicContact CZ-CG2 4.11Å
270	Q	94.9	Very high	95.6	Very high	93 Å²	93	33.3 Å²	33.3	44%	0.435	16%	0.163	S	C	.	.	H	α-helix	trans	-62.4	-45	176.1	-172.8	-174.4	-4	0	0	111.9	L266 R267 L268 L272 N273	L266-Q270 PolarHBondContact O-N 3.15Å; R267-Q270 PolarHBondContact O-N 3.17Å; L268-Q270 VanDerWaalsContact C-N 3.33Å; L268-Q270 PolarHBondContact O-N 3.17Å; Q270-L272 VanDerWaalsContact C-N 3.28Å; Q270-L272 PolarHBondContact O-N 3.44Å; Q270-N273 PolarHBondContact O-N 3.39Å; Q270-N273 VanDerWaalsContact O-N 3.07Å
271	Y	94	Very high	95.4	Very high	87 Å²	87	30.3 Å²	30.3	34%	0.341	15%	0.152	S	C	.	.	H	α-helix	trans	-58.6	-41.6	178.5	-176.9	-84.7	0	0	0	111.7	F230 R267 L268 N273 Y343 G344 I345	F230-Y271 HydrophobicContact CD1-CD2 4.46Å; F230-Y271 HydrophobicContact CE1-CD2 4.37Å; F230-Y271 HydrophobicContact CE1-CG 4.33Å; R267-Y271 WeakPolarHBondContact O-CB 3.33Å; R267-Y271 PolarHBondContact O-N 3.1Å; L268-Y271 PolarHBondContact O-N 3.17Å; Y271-N273 VanDerWaalsContact C-N 3.26Å; Y271-N273 PolarHBondContact O-N 3.06Å; Y271-Y343 PolarHBondContact OH-O 3.27Å; Y271-G344 PolarHBondContact OH-O 3.12Å; Y271-I345 HydrophobicContact CD1-CB 4.18Å; Y271-I345 HydrophobicContact CD1-CD1 3.61Å; Y271-I345 HydrophobicContact CD1-CG1 4.38Å; Y271-I345 HydrophobicContact CE1-CB 3.79Å; Y271-I345 HydrophobicContact CE1-CD1 3.77Å; Y271-I345 HydrophobicContact CE1-CG1 4.36Å; Y271-I345 HydrophobicContact CG-CD1 4.02Å
272	L	95.3	Very high	95	Very high	10 Å²	10	32.7 Å²	32.7	5%	0.052	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4.2	179.4	-65.7	173.6	0	0	0	113.4	L268 F269 Q270 L274 L328 H331 I345	L268-L272 HydrophobicContact CD1-CD1 3.72Å; L268-L272 HydrophobicContact CD1-CG 4.12Å; L268-L272 HydrophobicContact CG-CD1 3.99Å; L268-L272 WeakPolarHBondContact O-CB 3.47Å; L268-L272 WeakPolarHBondContact O-CG 3.46Å; L268-L272 PolarHBondContact O-N 2.93Å; F269-L272 CarbonylContact O-C 3.59Å; F269-L272 PolarHBondContact O-N 3.1Å; Q270-L272 VanDerWaalsContact C-N 3.28Å; Q270-L272 PolarHBondContact O-N 3.44Å; L272-L274 VanDerWaalsContact C-N 3.28Å; L272-L274 HydrophobicContact CB-CD1 4.14Å; L272-L274 HydrophobicContact CB-CD2 3.93Å; L272-L274 HydrophobicContact CB-CG 3.7Å; L272-L274 HydrophobicContact CD1-CD1 4.25Å; L272-L274 WeakPolarHBondContact O-CD2 3.45Å; L272-L274 PolarHBondContact O-N 3.42Å; L272-L328 HydrophobicContact CD1-CD1 3.64Å; L272-H331 HydrophobicContact CD2-CB 4.07Å; L272-I345 HydrophobicContact CD2-CB 4.47Å
273	N	95.2	Very high	94.8	Very high	100 Å²	100	38.2 Å²	38.2	54%	0.535	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	42.2	-177.7	-166.7	33.9	0	0	0	113.4	F269 Q270 Y271 N275 R327	F269-N273 PolarHBondContact O-N 3.12Å; F269-N273 VanDerWaalsContact O-N 3.09Å; Q270-N273 PolarHBondContact O-N 3.39Å; Q270-N273 VanDerWaalsContact O-N 3.07Å; Y271-N273 VanDerWaalsContact C-N 3.26Å; Y271-N273 PolarHBondContact O-N 3.06Å; N273-N275 PolarHBondContact O-N 3.27Å; N273-N275 PolarHBondContact O-ND2 3.5Å; N273-R327 WeakPolarHBondContact O-CD 3.4Å
274	L	97.3	Very high	94.6	Very high	11 Å²	11	42.5 Å²	42.5	6%	0.058	21%	0.21	C	C	.	.			trans	-86.2	101.3	178	-50.3	-174.5	0	0	0	109.2	F107 F269 L272 T277 D324 R327	F107-L274 HydrophobicContact CE1-CD1 3.56Å; F107-L274 HydrophobicContact CZ-CD1 4.09Å; F269-L274 HydrophobicContact CB-CB 4.21Å; F269-L274 HydrophobicContact CB-CD1 4.46Å; F269-L274 HydrophobicContact CD1-CD1 4.13Å; F269-L274 PolarHBondContact O-N 3.3Å; L272-L274 VanDerWaalsContact C-N 3.28Å; L272-L274 HydrophobicContact CB-CD1 4.14Å; L272-L274 HydrophobicContact CB-CD2 3.93Å; L272-L274 HydrophobicContact CB-CG 3.7Å; L272-L274 HydrophobicContact CD1-CD1 4.25Å; L272-L274 WeakPolarHBondContact O-CD2 3.45Å; L272-L274 PolarHBondContact O-N 3.42Å; L274-T277 WeakPolarHBondContact CB-OG1 3.36Å; L274-T277 HydrophobicContact CD1-CG2 4.35Å; L274-D324 WeakPolarHBondContact CA-OD1 3.22Å; L274-D324 HydrophobicContact CB-CB 4.19Å; L274-D324 HydrophobicContact CD2-CB 4.16Å; L274-D324 VanDerWaalsContact CD2-O 3.26Å; L274-D324 WeakPolarHBondContact CD2-O 3.32Å; L274-R327 HydrophobicContact CD2-CB 3.74Å
275	N	93.4	Very high	94.5	Very high	104 Å²	104	50.8 Å²	50.8	56%	0.556	25%	0.253	S	S	*	.	S	Bend	trans	-79.1	-24.8	-163.6	-69.8	-68.1	0	0	0	113.7	N273 D324	N273-N275 PolarHBondContact O-N 3.27Å; N273-N275 PolarHBondContact O-ND2 3.5Å; N275-D324 PolarHBondContact N-OD1 2.81Å
276	N	97	Very high	94.4	Very high	49 Å²	49	52.1 Å²	52.1	26%	0.262	26%	0.26	S	S	.	.	S	Bend	trans	-119.2	-9.9	-178.3	-54.4	-78.5	0	0	0	113	V97 C278 T321 D324	V97-N276 HydrophobicContact CG1-CB 3.82Å; V97-N276 WeakPolarHBondContact CG1-O 3.36Å; N276-C278 PolarHBondContact O-N 2.82Å; N276-T321 HydrophobicContact CB-CG2 3.58Å; N276-D324 WeakPolarHBondContact CA-OD2 3.35Å; N276-D324 VanDerWaalsContact CB-OD2 3.25Å; N276-D324 WeakPolarHBondContact CB-OD2 3.45Å; N276-D324 PolarHBondContact N-OD2 2.85Å
277	T	98.2	Very high	94.3	Very high	10 Å²	10	54 Å²	54	6%	0.061	28%	0.278	C	S	.	.			trans	-63.7	126.9	175.3	-54	0	0	0	0	110.6	F107 F269 L274 I318 L319 S320 D324	F107-T277 HydrophobicContact CE1-CG2 4.49Å; F107-T277 HydrophobicContact CZ-CG2 4.37Å; F269-T277 HydrophobicContact CD1-CG2 3.84Å; F269-T277 HydrophobicContact CD2-CG2 3.96Å; F269-T277 WeakPolarHBondContact CD2-O 3.27Å; F269-T277 HydrophobicContact CE1-CG2 3.78Å; F269-T277 HydrophobicContact CE2-CG2 3.91Å; F269-T277 HydrophobicContact CG-CG2 3.95Å; F269-T277 HydrophobicContact CZ-CG2 3.83Å; L274-T277 WeakPolarHBondContact CB-OG1 3.36Å; L274-T277 HydrophobicContact CD1-CG2 4.35Å; T277-I318 HydrophobicContact CG2-CG2 3.54Å; T277-L319 VanDerWaalsContact CA-O 3.31Å; T277-L319 WeakPolarHBondContact CA-O 3.3Å; T277-S320 PolarHBondContact OG1-OG 2.9Å; T277-D324 PolarHBondContact N-OD2 3.48Å; T277-D324 VanDerWaalsContact OG1-CB 3.26Å; T277-D324 WeakPolarHBondContact OG1-CB 3.38Å
278	C	97.3	Very high	94.3	Very high	30 Å²	30	55.3 Å²	55.3	20%	0.203	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	165.1	-178.1	57	0	0	0	0	111.8	N276 L319	N276-C278 PolarHBondContact O-N 2.82Å; C278-L319 PolarHBondContact N-O 2.77Å; C278-L319 PolarHBondContact O-N 2.84Å
279	L	96.2	Very high	94.3	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	139.2	173.2	-56.7	179.3	0	0	0	109.7	D262 L265 L266 F269 Y281 W313 I318	D262-L279 HydrophobicContact CB-CD1 3.5Å; D262-L279 VanDerWaalsContact CB-CD1 3.5Å; L265-L279 HydrophobicContact CB-CD2 4.17Å; L265-L279 HydrophobicContact CD1-CD2 3.65Å; L266-L279 HydrophobicContact CD2-CD1 4.5Å; L266-L279 HydrophobicContact CD2-CG 4.32Å; L266-L279 HydrophobicContact CG-CD1 4.39Å; F269-L279 HydrophobicContact CE2-CD2 4.03Å; F269-L279 HydrophobicContact CE2-CG 4.36Å; F269-L279 HydrophobicContact CZ-CD2 4.07Å; L279-Y281 HydrophobicContact CB-CD2 4.19Å; L279-Y281 HydrophobicContact CB-CE2 3.67Å; L279-Y281 HydrophobicContact CD1-CE2 4.38Å; L279-Y281 WeakPolarHBondContact O-CD2 3.3Å; L279-Y281 PolarHBondContact O-N 2.78Å; L279-W313 HydrophobicContact CB-CD2 4.33Å; L279-W313 HydrophobicContact CB-CG 4.46Å; L279-W313 HydrophobicContact CB-CZ2 4.27Å; L279-W313 HydrophobicContact CD1-CD2 4.07Å; L279-W313 HydrophobicContact CD1-CE3 4.17Å; L279-W313 HydrophobicContact CD1-CZ3 4.44Å; L279-W313 HydrophobicContact CD2-CB 4.23Å; L279-W313 HydrophobicContact CD2-CD2 4.41Å; L279-W313 HydrophobicContact CD2-CG 4.03Å; L279-I318 HydrophobicContact CD2-CG1 4.1Å
280	E	94.3	Very high	94.4	Very high	3 Å²	3	58.5 Å²	58.5	1%	0.014	30%	0.303	C	S	.	.			trans	-75.5	113.9	175.2	-169	169.7	-167.3	0	0	110.3	R99 N309 W313 G317 L319	R99-E280 IonicContact CZ-OE1 3.7Å; R99-E280 IonicContact CZ-OE2 3.22Å; R99-E280 VanDerWaalsContact NE-CD 3.35Å; R99-E280 IonicContact NE-OE1 3.39Å; R99-E280 PolarHBondContact NE-OE1 2.64Å; R99-E280 IonicContact NE-OE2 2.88Å; R99-E280 PolarHBondContact NE-OE2 2.8Å; R99-E280 IonicContact NH2-OE1 2.57Å; R99-E280 PolarHBondContact NH2-OE1 2.99Å; R99-E280 IonicContact NH2-OE2 2.79Å; E280-N309 PolarHBondContact OE2-ND2 3.26Å; E280-W313 PolarHBondContact O-NE1 3.3Å; E280-G317 WeakPolarHBondContact CB-O 3.49Å; E280-G317 PolarHBondContact N-O 2.93Å; E280-L319 HydrophobicContact CB-CD1 4.38Å; E280-L319 HydrophobicContact CB-CD2 4.18Å; E280-L319 HydrophobicContact CB-CG 4.01Å; E280-L319 HydrophobicContact CG-CD1 4.34Å; E280-L319 HydrophobicContact CG-CD2 4.29Å; E280-L319 HydrophobicContact CG-CG 4.37Å
281	Y	90.7	Very high	94.5	Very high	22 Å²	22	54.8 Å²	54.8	9%	0.086	29%	0.289	C	S	.	.			trans	-112.5	116.7	167.2	-67.4	-92.5	0	0	0	107.6	D262 L279 E283 K284 R289 W313	D262-Y281 PolarHBondContact OD2-OH 2.88Å; L279-Y281 HydrophobicContact CB-CD2 4.19Å; L279-Y281 HydrophobicContact CB-CE2 3.67Å; L279-Y281 HydrophobicContact CD1-CE2 4.38Å; L279-Y281 WeakPolarHBondContact O-CD2 3.3Å; L279-Y281 PolarHBondContact O-N 2.78Å; Y281-E283 WeakPolarHBondContact CD1-OE1 3.32Å; Y281-E283 PolarHBondContact O-N 2.75Å; Y281-K284 HydrophobicContact CD2-CD 3.76Å; Y281-K284 HydrophobicContact CE2-CD 4.47Å; Y281-K284 HydrophobicContact CG-CD 3.79Å; Y281-K284 HydrophobicContact CG-CG 4.2Å; Y281-K284 PolarHBondContact O-N 3.32Å; Y281-R289 PolarHBondContact O-NH2 3.09Å; Y281-W313 HydrophobicContact CD1-CH2 4.13Å; Y281-W313 AromaticContact CD1-CZ2 3.78Å; Y281-W313 HydrophobicContact CD1-CZ2 3.78Å; Y281-W313 HydrophobicContact CD2-CZ2 4.34Å; Y281-W313 AromaticContact CE1-CH2 3.3Å; Y281-W313 HydrophobicContact CE1-CH2 3.3Å; Y281-W313 AromaticContact CE1-CZ2 3.35Å; Y281-W313 HydrophobicContact CE1-CZ2 3.35Å; Y281-W313 HydrophobicContact CE2-CH2 4.4Å; Y281-W313 AromaticContact CE2-CZ2 3.99Å; Y281-W313 HydrophobicContact CE2-CZ2 3.99Å; Y281-W313 HydrophobicContact CG-CZ2 4.24Å; Y281-W313 AromaticContact CZ-CH2 3.43Å; Y281-W313 VanDerWaalsContact CZ-CH2 3.43Å; Y281-W313 AromaticContact CZ-CZ2 3.43Å; Y281-W313 VanDerWaalsContact CZ-CZ2 3.43Å; Y281-W313 WeakPolarHBondContact OH-CH2 3.22Å
282	P	88.1	Confident	94.6	Very high	52 Å²	52	52.1 Å²	52.1	34%	0.338	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-36.3	-179.4	-27.5	35.6	0	0	0	113.5	D308	P282-D308 HydrophobicContact CG-CB 3.93Å
283	E	89.3	Confident	94.7	Very high	125 Å²	125	51.8 Å²	51.8	58%	0.584	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-19.3	-176.3	72.8	-77.8	-174.6	0	0	114.4	Y281	Y281-E283 WeakPolarHBondContact CD1-OE1 3.32Å; Y281-E283 PolarHBondContact O-N 2.75Å
284	K	90.5	Very high	94.7	Very high	104 Å²	104	48.1 Å²	48.1	45%	0.452	26%	0.259	S	S	.	.	S	Bend	trans	-88.5	138.3	-177.6	-64.6	-173.2	-176.2	175.8	0	111.5	Y281 I286 R289	Y281-K284 HydrophobicContact CD2-CD 3.76Å; Y281-K284 HydrophobicContact CE2-CD 4.47Å; Y281-K284 HydrophobicContact CG-CD 3.79Å; Y281-K284 HydrophobicContact CG-CG 4.2Å; Y281-K284 PolarHBondContact O-N 3.32Å; K284-I286 PolarHBondContact O-N 3.35Å; K284-R289 PolarHBondContact O-NH2 2.9Å
285	I	93.3	Very high	94.4	Very high	174 Å²	174	52.5 Å²	52.5	89%	0.892	28%	0.275	S	S	*	.			trans	-70.4	117.3	165.6	-61.4	170.6	0	0	0	107.9
286	I	93.8	Very high	94	Very high	29 Å²	29	49.6 Å²	49.6	15%	0.149	26%	0.263	C	S	.	.			trans	-109.6	121.5	175	-66.6	180	0	0	0	108.2	V97 K284 R289 L319	V97-I286 HydrophobicContact CG2-CG2 3.74Å; K284-I286 PolarHBondContact O-N 3.35Å; I286-R289 HydrophobicContact CB-CB 4.29Å; I286-R289 HydrophobicContact CG2-CB 4.23Å; I286-R289 WeakPolarHBondContact O-CB 2.71Å; I286-R289 PolarHBondContact O-N 3.03Å; I286-L319 HydrophobicContact CD1-CD1 3.52Å; I286-L319 HydrophobicContact CG2-CD1 4.14Å
287	S	93.4	Very high	93.3	Very high	99 Å²	99	54 Å²	54	69%	0.692	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	140.2	178.5	-172.4	0	0	0	0	110.7	R289	S287-R289 PolarHBondContact O-N 3.32Å; S287-R289 VanDerWaalsContact O-N 3.07Å
288	S	95.5	Very high	92.8	Very high	52 Å²	52	62.4 Å²	62.4	36%	0.364	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	22.8	175.2	-51	0	0	0	0	114.8	N95 T96 V97 A290	N95-S288 WeakPolarHBondContact O-CB 3.42Å; T96-S288 WeakPolarHBondContact CA-O 3.41Å; V97-S288 PolarHBondContact N-O 2.71Å; S288-A290 PolarHBondContact O-N 2.86Å
289	R	96.8	Very high	92.4	Very high	70 Å²	70	62.7 Å²	62.7	26%	0.264	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-64.2	120.9	175.3	-172.3	-170.3	-70	170.2	2.7	109.9	V97 Y281 K284 I286 S287 L319	V97-R289 HydrophobicContact CG2-CB 4.14Å; Y281-R289 PolarHBondContact O-NH2 3.09Å; K284-R289 PolarHBondContact O-NH2 2.9Å; I286-R289 HydrophobicContact CB-CB 4.29Å; I286-R289 HydrophobicContact CG2-CB 4.23Å; I286-R289 WeakPolarHBondContact O-CB 2.71Å; I286-R289 PolarHBondContact O-N 3.03Å; S287-R289 PolarHBondContact O-N 3.32Å; S287-R289 VanDerWaalsContact O-N 3.07Å; R289-L319 HydrophobicContact CG-CD1 4.3Å
290	A	97.8	Very high	92.3	Very high	2 Å²	2	67.4 Å²	67.4	2%	0.017	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-64.9	135.2	169.4	0	0	0	0	0	109.8	A84 T96 V97 F98 S288 Q292 N479	A84-A290 HydrophobicContact CB-CB 4.37Å; A84-A290 CarbonylContact O-C 3.6Å; A84-A290 WeakPolarHBondContact O-CA 3.17Å; T96-A290 HydrophobicContact CG2-CB 3.83Å; V97-A290 PolarHBondContact O-N 2.71Å; F98-A290 HydrophobicContact CD1-CB 3.68Å; F98-A290 HydrophobicContact CE1-CB 3.67Å; F98-A290 HydrophobicContact CG-CB 4.18Å; F98-A290 HydrophobicContact CZ-CB 4.16Å; S288-A290 PolarHBondContact O-N 2.86Å; A290-Q292 PolarHBondContact O-NE2 3.2Å; A290-N479 HydrophobicContact CB-CB 4.2Å
291	A	97.1	Very high	92.3	Very high	15 Å²	15	69.9 Å²	69.9	12%	0.124	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-60.8	163.5	165.8	0	0	0	0	0	110.1	A84 N85 Y293 N479	A84-A291 PolarHBondContact O-N 3.1Å; N85-A291 HydrophobicContact CB-CB 4.24Å; A291-Y293 HydrophobicContact CB-CE1 4.44Å; A291-Y293 HydrophobicContact CB-CE2 3.83Å; A291-Y293 VanDerWaalsContact CB-OH 3.27Å; A291-Y293 WeakPolarHBondContact CB-OH 3.43Å; A291-N479 WeakPolarHBondContact O-CB 3.24Å
292	Q	96.2	Very high	92.5	Very high	31 Å²	31	71.7 Å²	71.7	15%	0.145	38%	0.38	C	S	.	.			trans	-120.9	123.8	-170	-76.6	106.3	42.2	0	0	110.3	A290 T304	A290-Q292 PolarHBondContact O-NE2 3.2Å; Q292-T304 HydrophobicContact CB-CG2 4.27Å; Q292-T304 VanDerWaalsContact CB-OG1 3.25Å; Q292-T304 WeakPolarHBondContact CB-OG1 3.41Å; Q292-T304 PolarHBondContact O-N 2.81Å
293	Y	97.4	Very high	92.9	Very high	2 Å²	2	73.6 Å²	73.6	1%	0.008	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.1	-174.7	-54.9	-75.3	0	0	0	112.7	P63 N85 V86 E87 A291 L301 T302 N479 L480 E481	P63-Y293 HydrophobicContact CB-CD2 3.95Å; P63-Y293 HydrophobicContact CB-CE2 4.18Å; P63-Y293 HydrophobicContact CG-CD2 3.74Å; P63-Y293 HydrophobicContact CG-CE2 4.44Å; P63-Y293 HydrophobicContact CG-CG 4.12Å; N85-Y293 WeakPolarHBondContact CA-OH 3.44Å; V86-Y293 HydrophobicContact CB-CE1 4.39Å; V86-Y293 HydrophobicContact CG2-CE1 4.3Å; V86-Y293 HydrophobicContact CG2-CE2 3.84Å; V86-Y293 PolarHBondContact N-OH 3.5Å; E87-Y293 PolarHBondContact OE2-OH 3.29Å; A291-Y293 HydrophobicContact CB-CE1 4.44Å; A291-Y293 HydrophobicContact CB-CE2 3.83Å; A291-Y293 VanDerWaalsContact CB-OH 3.27Å; A291-Y293 WeakPolarHBondContact CB-OH 3.43Å; Y293-L301 HydrophobicContact CD1-CD1 4.47Å; Y293-L301 HydrophobicContact CD1-CD2 3.99Å; Y293-L301 HydrophobicContact CD1-CG 4Å; Y293-L301 HydrophobicContact CE1-CD2 4.43Å; Y293-L301 HydrophobicContact CG-CD1 4.13Å; Y293-L301 HydrophobicContact CG-CD2 4.13Å; Y293-L301 HydrophobicContact CG-CG 4.14Å; Y293-T302 WeakPolarHBondContact CA-O 3.38Å; Y293-N479 WeakPolarHBondContact CB-O 3.19Å; Y293-N479 HydrophobicContact CD2-CB 4.31Å; Y293-N479 WeakPolarHBondContact CD2-O 3.19Å; Y293-N479 PolarHBondContact N-O 3.38Å; Y293-L480 WeakPolarHBondContact O-CA 3.42Å; Y293-E481 PolarHBondContact O-N 3.09Å
294	C	94.6	Very high	93.1	Very high	24 Å²	24	68.4 Å²	68.4	16%	0.162	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	164.7	161.8	63.4	0	0	0	0	109	T302 T304 E481	C294-T302 PolarHBondContact N-O 3.29Å; C294-T302 PolarHBondContact O-N 2.91Å; C294-T302 PolarHBondContact SG-OG1 3.08Å; C294-T304 HydrophobicContact CB-CG2 3.94Å; C294-E481 HydrophobicContact CB-CB 4.39Å; C294-E481 HydrophobicContact CB-CG 4.19Å; C294-E481 WeakPolarHBondContact CB-OE2 3.28Å
295	R	91.1	Very high	93.1	Very high	103 Å²	103	66.8 Å²	66.8	39%	0.389	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.3	176.5	-165.4	177.8	-67	-88.2	1.9	108.7	G61 G299 I300 L480	G61-R295 PolarHBondContact O-NH2 3.15Å; R295-G299 PolarHBondContact NH1-O 2.89Å; R295-I300 WeakPolarHBondContact CA-O 3.39Å; R295-L480 HydrophobicContact CB-CD1 4.39Å
296	S	85.9	Confident	93.1	Very high	42 Å²	42	64 Å²	64	29%	0.294	36%	0.356	S	S	.	.			trans	-68.6	164.7	171.4	65.5	0	0	0	0	111.2	K298 G299 I300	S296-K298 PolarHBondContact O-N 3.08Å; S296-G299 PolarHBondContact O-N 3.2Å; S296-I300 PolarHBondContact N-O 3.32Å; S296-I300 WeakPolarHBondContact OG-CB 3.48Å; S296-I300 PolarHBondContact OG-N 2.9Å; S296-I300 VanDerWaalsContact OG-N 3.16Å; S296-I300 PolarHBondContact OG-O 3.29Å
297	D	82.5	Confident	93	Very high	142 Å²	142	62.7 Å²	62.7	76%	0.759	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-16	177.1	-52.1	-31.8	0	0	0	112.2	K170 G299	K170-D297 VanDerWaalsContact NZ-CG 3.26Å; K170-D297 IonicContact NZ-OD1 2.88Å; K170-D297 PolarHBondContact NZ-OD1 3.33Å; K170-D297 IonicContact NZ-OD2 2.73Å; K170-D297 PolarHBondContact NZ-OD2 2.67Å; D297-G299 VanDerWaalsContact C-N 3.33Å
298	K	87.8	Confident	93.1	Very high	187 Å²	187	58.5 Å²	58.5	81%	0.813	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	4.7	172.9	-64.1	-176.8	-179.7	177.9	0	113.7	S296 I300	S296-K298 PolarHBondContact O-N 3.08Å; K298-I300 VanDerWaalsContact C-N 3.28Å; K298-I300 HydrophobicContact CB-CD1 4.43Å; K298-I300 HydrophobicContact CB-CG1 4.38Å; K298-I300 PolarHBondContact O-N 3.28Å
299	G	88.4	Confident	93	Very high	36 Å²	36	56 Å²	56	37%	0.371	30%	0.302	S	S	.	.	S	Bend	trans	80.4	1	-179.2	0	0	0	0	0	115	R295 S296 D297 L301	R295-G299 PolarHBondContact NH1-O 2.89Å; S296-G299 PolarHBondContact O-N 3.2Å; D297-G299 VanDerWaalsContact C-N 3.33Å; G299-L301 PolarHBondContact O-N 3.47Å
300	I	93.7	Very high	92.8	Very high	102 Å²	102	53.2 Å²	53.2	52%	0.523	29%	0.293	S	S	.	.			trans	-74.1	127	179.6	-55.9	171.7	0	0	0	109.2	R295 S296 K298 T302	R295-I300 WeakPolarHBondContact CA-O 3.39Å; S296-I300 PolarHBondContact N-O 3.32Å; S296-I300 WeakPolarHBondContact OG-CB 3.48Å; S296-I300 PolarHBondContact OG-N 2.9Å; S296-I300 VanDerWaalsContact OG-N 3.16Å; S296-I300 PolarHBondContact OG-O 3.29Å; K298-I300 VanDerWaalsContact C-N 3.28Å; K298-I300 HydrophobicContact CB-CD1 4.43Å; K298-I300 HydrophobicContact CB-CG1 4.38Å; K298-I300 PolarHBondContact O-N 3.28Å; I300-T302 HydrophobicContact CG2-CG2 4.23Å
301	L	95.5	Very high	92.6	Very high	54 Å²	54	53.5 Å²	53.5	28%	0.283	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	130	173.7	-168.2	75.3	0	0	0	109.7	P63 V86 Y293 G299 L480	P63-L301 HydrophobicContact CB-CD2 4.23Å; P63-L301 HydrophobicContact CG-CD1 3.66Å; P63-L301 HydrophobicContact CG-CD2 3.69Å; P63-L301 HydrophobicContact CG-CG 4.33Å; V86-L301 HydrophobicContact CG2-CD2 4.02Å; Y293-L301 HydrophobicContact CD1-CD1 4.47Å; Y293-L301 HydrophobicContact CD1-CD2 3.99Å; Y293-L301 HydrophobicContact CD1-CG 4Å; Y293-L301 HydrophobicContact CE1-CD2 4.43Å; Y293-L301 HydrophobicContact CG-CD1 4.13Å; Y293-L301 HydrophobicContact CG-CD2 4.13Å; Y293-L301 HydrophobicContact CG-CG 4.14Å; G299-L301 PolarHBondContact O-N 3.47Å; L301-L480 HydrophobicContact CD1-CD1 4.05Å
302	T	94.7	Very high	92.5	Very high	60 Å²	60	53.3 Å²	53.3	37%	0.368	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	152.4	178.9	51.4	0	0	0	0	110.5	Y293 C294 I300	Y293-T302 WeakPolarHBondContact CA-O 3.38Å; C294-T302 PolarHBondContact N-O 3.29Å; C294-T302 PolarHBondContact O-N 2.91Å; C294-T302 PolarHBondContact SG-OG1 3.08Å; I300-T302 HydrophobicContact CG2-CG2 4.23Å
303	N	95	Very high	92.5	Very high	92 Å²	92	52.8 Å²	52.8	49%	0.492	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	144.7	167.4	-73.4	-66.2	0	0	0	110.3	E87	E87-N303 PolarHBondContact OE1-ND2 3.03Å; E87-N303 PolarHBondContact OE1-OD1 2.89Å
304	T	93.7	Very high	92.5	Very high	17 Å²	17	52.8 Å²	52.8	10%	0.104	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-77	158	174	60.8	0	0	0	0	112.1	Q292 C294 V402 E481	Q292-T304 HydrophobicContact CB-CG2 4.27Å; Q292-T304 VanDerWaalsContact CB-OG1 3.25Å; Q292-T304 WeakPolarHBondContact CB-OG1 3.41Å; Q292-T304 PolarHBondContact O-N 2.81Å; C294-T304 HydrophobicContact CB-CG2 3.94Å; T304-V402 HydrophobicContact CG2-CG1 3.97Å; T304-E481 HydrophobicContact CG2-CG 4.44Å; T304-E481 WeakPolarHBondContact CG2-OE1 3.48Å
305	P	91.5	Very high	92.6	Very high	70 Å²	70	51.6 Å²	51.6	46%	0.455	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-54.6	152.4	169	-23.9	34.1	0	0	0	112.7
306	T	91.5	Very high	92.8	Very high	114 Å²	114	47.1 Å²	47.1	70%	0.699	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-69.7	138.9	169.6	-60.8	0	0	0	0	109.6	T179	T179-T306 VanDerWaalsContact CG2-O 3.27Å; T179-T306 WeakPolarHBondContact CG2-O 3.09Å
307	I	93.5	Very high	93.2	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.015	25%	0.251	C	S	.	.			trans	-140.4	159.1	178.6	65.7	176.8	0	0	0	110.3	L177 N309 V402	L177-I307 HydrophobicContact CB-CG2 4.43Å; L177-I307 HydrophobicContact CD2-CG2 4.24Å; I307-N309 WeakPolarHBondContact CD1-ND2 3.33Å; I307-N309 WeakPolarHBondContact CD1-OD1 3.14Å; I307-V402 HydrophobicContact CD1-CB 3.63Å; I307-V402 HydrophobicContact CD1-CG1 4.2Å; I307-V402 HydrophobicContact CD1-CG2 3.81Å; I307-V402 HydrophobicContact CG2-CG1 4.39Å; I307-V402 HydrophobicContact CG2-CG2 4.36Å
308	D	94.4	Very high	93.9	Very high	10 Å²	10	38.4 Å²	38.4	5%	0.053	22%	0.215	C	C	.	.			trans	-112.1	111.1	167.8	-170.1	-23.8	0	0	0	109.7	N178 R181 P282 S310 Y311	N178-D308 PolarHBondContact O-N 2.98Å; R181-D308 WeakPolarHBondContact CA-OD2 3.41Å; R181-D308 WeakPolarHBondContact CB-OD2 3.27Å; R181-D308 WeakPolarHBondContact CD-OD2 3.11Å; P282-D308 HydrophobicContact CG-CB 3.93Å; D308-S310 VanDerWaalsContact CG-OG 3.28Å; D308-S310 WeakPolarHBondContact OD1-CB 3.3Å; D308-S310 PolarHBondContact OD1-N 3.04Å; D308-S310 PolarHBondContact OD1-OG 3.36Å; D308-S310 PolarHBondContact OD2-OG 2.89Å; D308-Y311 VanDerWaalsContact O-CD1 3.3Å; D308-Y311 WeakPolarHBondContact O-CD1 3.48Å; D308-Y311 WeakPolarHBondContact O-CE1 3.35Å
309	N	94.2	Very high	94.4	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	18%	0.177	C	C	.	.			trans	-89.3	2.4	-179.7	-72	-34.8	0	0	0	113.8	E280 I307 Y311 K312 W313	E280-N309 PolarHBondContact OE2-ND2 3.26Å; I307-N309 WeakPolarHBondContact CD1-ND2 3.33Å; I307-N309 WeakPolarHBondContact CD1-OD1 3.14Å; N309-Y311 VanDerWaalsContact C-N 3.32Å; N309-Y311 PolarHBondContact O-N 2.94Å; N309-K312 HydrophobicContact CB-CG 4.4Å; N309-K312 CarbonylContact O-C 3.5Å; N309-K312 VanDerWaalsContact O-CG 3.24Å; N309-K312 WeakPolarHBondContact O-CG 3.14Å; N309-K312 PolarHBondContact O-N 3.16Å; N309-K312 WeakPolarHBondContact OD1-CE 3.33Å; N309-K312 PolarHBondContact OD1-NZ 3.27Å; N309-K312 VanDerWaalsContact OD1-NZ 3.1Å; N309-W313 PolarHBondContact O-N 2.95Å
310	S	93.1	Very high	94.9	Very high	10 Å²	10	27.9 Å²	27.9	7%	0.07	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-64.1	-33.5	-172.3	60.6	0	0	0	0	114.5	R181 D308 K312 W313	R181-S310 WeakPolarHBondContact CD-OG 3.49Å; R181-S310 PolarHBondContact NH1-OG 3.44Å; D308-S310 VanDerWaalsContact CG-OG 3.28Å; D308-S310 WeakPolarHBondContact OD1-CB 3.3Å; D308-S310 PolarHBondContact OD1-N 3.04Å; D308-S310 PolarHBondContact OD1-OG 3.36Å; D308-S310 PolarHBondContact OD2-OG 2.89Å; S310-K312 PolarHBondContact O-N 3.33Å; S310-K312 VanDerWaalsContact O-N 3.14Å; S310-W313 VanDerWaalsContact CA-CE2 3.48Å; S310-W313 VanDerWaalsContact CB-CZ2 3.46Å; S310-W313 PolarHBondContact O-N 2.81Å
311	Y	93.5	Very high	95.1	Very high	9 Å²	9	23 Å²	23	4%	0.035	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-61.7	-22.2	174.8	78.8	-95	0	0	0	112.8	Y161 E175 N178 F182 M191 F210 T213 D308 N309	Y161-Y311 HydrophobicContact CE1-CE2 4.28Å; Y161-Y311 WeakPolarHBondContact CE1-OH 3.39Å; Y161-Y311 PolarHBondContact OH-OH 3.21Å; Y161-Y311 VanDerWaalsContact OH-OH 3.09Å; E175-Y311 PolarHBondContact O-OH 2.99Å; N178-Y311 HydrophobicContact CB-CE1 3.89Å; F182-Y311 HydrophobicContact CD2-CG 4.47Å; F182-Y311 HydrophobicContact CE2-CG 4.32Å; M191-Y311 HydrophobicContact CE-CE2 4.42Å; M191-Y311 HydrophobicContact SD-CD2 3.96Å; M191-Y311 HydrophobicContact SD-CE2 4.09Å; M191-Y311 HydrophobicContact SD-CG 4.29Å; F210-Y311 HydrophobicContact CE1-CE2 4.01Å; T213-Y311 VanDerWaalsContact CG2-O 3.25Å; T213-Y311 WeakPolarHBondContact CG2-O 3.36Å; T213-Y311 PolarHBondContact OG1-O 2.9Å; D308-Y311 VanDerWaalsContact O-CD1 3.3Å; D308-Y311 WeakPolarHBondContact O-CD1 3.48Å; D308-Y311 WeakPolarHBondContact O-CE1 3.35Å; N309-Y311 VanDerWaalsContact C-N 3.32Å; N309-Y311 PolarHBondContact O-N 2.94Å
312	K	94.1	Very high	95.3	Very high	11 Å²	11	20.4 Å²	20.4	5%	0.048	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-124	27.2	-173.9	63.2	179	172.9	-155.5	0	113.3	Y161 M176 T209 N309 S310 A314 G315 G316 G317	Y161-K312 VanDerWaalsContact OH-CD 3.24Å; Y161-K312 WeakPolarHBondContact OH-CD 3.41Å; M176-K312 PolarHBondContact O-NZ 3.42Å; T209-K312 HydrophobicContact CG2-CB 3.74Å; T209-K312 HydrophobicContact CG2-CD 4.04Å; T209-K312 HydrophobicContact CG2-CG 4.5Å; N309-K312 HydrophobicContact CB-CG 4.4Å; N309-K312 CarbonylContact O-C 3.5Å; N309-K312 VanDerWaalsContact O-CG 3.24Å; N309-K312 WeakPolarHBondContact O-CG 3.14Å; N309-K312 PolarHBondContact O-N 3.16Å; N309-K312 WeakPolarHBondContact OD1-CE 3.33Å; N309-K312 PolarHBondContact OD1-NZ 3.27Å; N309-K312 VanDerWaalsContact OD1-NZ 3.1Å; S310-K312 PolarHBondContact O-N 3.33Å; S310-K312 VanDerWaalsContact O-N 3.14Å; K312-A314 PolarHBondContact O-N 3.06Å; K312-A314 VanDerWaalsContact O-N 3.12Å; K312-G315 CarbonylContact O-C 3.57Å; K312-G315 PolarHBondContact O-N 2.89Å; K312-G316 PolarHBondContact O-N 3.32Å; K312-G317 PolarHBondContact O-N 2.98Å; K312-G317 VanDerWaalsContact O-N 3.15Å
313	W	95.8	Very high	95.4	Very high	20 Å²	20	17.8 Å²	17.8	8%	0.076	11%	0.105	C	C	.	.	H	α-helix	trans	-50.3	-39.4	174.1	-72.9	-37.9	0	0	0	112.5	S104 F261 D262 L265 L279 E280 Y281 N309 S310 G315	S104-W313 WeakPolarHBondContact CB-O 3.4Å; F261-W313 HydrophobicContact CE1-CB 4.38Å; D262-W313 HydrophobicContact CB-CE3 3.91Å; D262-W313 HydrophobicContact CB-CH2 4.37Å; D262-W313 HydrophobicContact CB-CZ3 3.6Å; L265-W313 HydrophobicContact CD1-CB 4.17Å; L279-W313 HydrophobicContact CB-CD2 4.33Å; L279-W313 HydrophobicContact CB-CG 4.46Å; L279-W313 HydrophobicContact CB-CZ2 4.27Å; L279-W313 HydrophobicContact CD1-CD2 4.07Å; L279-W313 HydrophobicContact CD1-CE3 4.17Å; L279-W313 HydrophobicContact CD1-CZ3 4.44Å; L279-W313 HydrophobicContact CD2-CB 4.23Å; L279-W313 HydrophobicContact CD2-CD2 4.41Å; L279-W313 HydrophobicContact CD2-CG 4.03Å; E280-W313 PolarHBondContact O-NE1 3.3Å; Y281-W313 HydrophobicContact CD1-CH2 4.13Å; Y281-W313 AromaticContact CD1-CZ2 3.78Å; Y281-W313 HydrophobicContact CD1-CZ2 3.78Å; Y281-W313 HydrophobicContact CD2-CZ2 4.34Å; Y281-W313 AromaticContact CE1-CH2 3.3Å; Y281-W313 HydrophobicContact CE1-CH2 3.3Å; Y281-W313 AromaticContact CE1-CZ2 3.35Å; Y281-W313 HydrophobicContact CE1-CZ2 3.35Å; Y281-W313 HydrophobicContact CE2-CH2 4.4Å; Y281-W313 AromaticContact CE2-CZ2 3.99Å; Y281-W313 HydrophobicContact CE2-CZ2 3.99Å; Y281-W313 HydrophobicContact CG-CZ2 4.24Å; Y281-W313 AromaticContact CZ-CH2 3.43Å; Y281-W313 VanDerWaalsContact CZ-CH2 3.43Å; Y281-W313 AromaticContact CZ-CZ2 3.43Å; Y281-W313 VanDerWaalsContact CZ-CZ2 3.43Å; Y281-W313 WeakPolarHBondContact OH-CH2 3.22Å; N309-W313 PolarHBondContact O-N 2.95Å; S310-W313 VanDerWaalsContact CA-CE2 3.48Å; S310-W313 VanDerWaalsContact CB-CZ2 3.46Å; S310-W313 PolarHBondContact O-N 2.81Å; W313-G315 PolarHBondContact O-N 3.13Å
314	A	97.5	Very high	95.6	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-61.7	-27.6	177.9	0	0	0	0	0	114.7	S104 T108 F212 F261 K312	S104-A314 CarbonylContact C-O 3.52Å; T108-A314 HydrophobicContact CG2-CB 4.18Å; T108-A314 WeakPolarHBondContact OG1-CA 3.23Å; T108-A314 PolarHBondContact OG1-O 3.04Å; F212-A314 HydrophobicContact CB-CB 4.2Å; F212-A314 WeakPolarHBondContact CD1-O 3.45Å; F212-A314 WeakPolarHBondContact O-CB 3.31Å; F261-A314 HydrophobicContact CE1-CB 3.52Å; F261-A314 HydrophobicContact CE2-CB 4.35Å; F261-A314 HydrophobicContact CZ-CB 3.41Å; F261-A314 VanDerWaalsContact CZ-CB 3.41Å; K312-A314 PolarHBondContact O-N 3.06Å; K312-A314 VanDerWaalsContact O-N 3.12Å
315	G	96.3	Very high	95.8	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-123.5	-7.6	-171.1	0	0	0	0	0	115.4	S102 K105 K312 W313	S102-G315 WeakPolarHBondContact CA-O 3.38Å; K105-G315 PolarHBondContact NZ-O 2.98Å; K312-G315 CarbonylContact O-C 3.57Å; K312-G315 PolarHBondContact O-N 2.89Å; W313-G315 PolarHBondContact O-N 3.13Å
316	G	95.2	Very high	96.2	Very high	9 Å²	9	9.3 Å²	9.3	9%	0.093	6%	0.055	C	C	.	.	H	α-helix	trans	-176.3	1.3	-168.8	0	0	0	0	0	118.8	A101 K312	A101-G316 WeakPolarHBondContact O-CA 3.37Å; K312-G316 PolarHBondContact O-N 3.32Å
317	G	94.9	Very high	96.5	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.036	C	C	.	.			trans	-112.2	14.4	-167.6	0	0	0	0	0	116.7	S104 E280 K312	S104-G317 PolarHBondContact OG-N 2.98Å; E280-G317 WeakPolarHBondContact CB-O 3.49Å; E280-G317 PolarHBondContact N-O 2.93Å; K312-G317 PolarHBondContact O-N 2.98Å; K312-G317 VanDerWaalsContact O-N 3.15Å
318	I	97.7	Very high	96.7	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.005	4%	0.035	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	144.1	177.4	-61.1	175.2	0	0	0	110.3	I100 S104 F107 L265 F269 T277 L279	I100-I318 HydrophobicContact CD1-CB 3.83Å; I100-I318 HydrophobicContact CD1-CG2 3.59Å; I100-I318 HydrophobicContact CG1-CB 3.87Å; I100-I318 HydrophobicContact CG1-CG2 4.01Å; I100-I318 WeakPolarHBondContact CG1-O 3.32Å; I100-I318 PolarHBondContact N-O 2.83Å; I100-I318 VanDerWaalsContact N-O 3.08Å; S104-I318 WeakPolarHBondContact OG-CB 3.45Å; S104-I318 PolarHBondContact OG-N 2.91Å; F107-I318 HydrophobicContact CB-CD1 4.08Å; F107-I318 HydrophobicContact CD2-CD1 3.9Å; F107-I318 HydrophobicContact CE2-CD1 4.46Å; F107-I318 HydrophobicContact CG-CD1 3.95Å; L265-I318 HydrophobicContact CD1-CD1 4.39Å; L265-I318 HydrophobicContact CD2-CD1 4.39Å; F269-I318 HydrophobicContact CE1-CD1 4.04Å; F269-I318 HydrophobicContact CZ-CD1 3.74Å; F269-I318 HydrophobicContact CZ-CG1 4.11Å; F269-I318 HydrophobicContact CZ-CG2 4.11Å; T277-I318 HydrophobicContact CG2-CG2 3.54Å; L279-I318 HydrophobicContact CD2-CG1 4.1Å
319	L	98.2	Very high	96.9	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.005	3%	0.033	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144.2	163.5	-53.5	-176.8	0	0	0	109.6	V97 F98 R99 T277 C278 E280 I286 R289	V97-L319 HydrophobicContact CB-CB 4.28Å; V97-L319 HydrophobicContact CG2-CB 4.4Å; V97-L319 HydrophobicContact CG2-CD1 4.32Å; F98-L319 CarbonylContact O-C 3.52Å; F98-L319 VanDerWaalsContact O-CA 3.24Å; F98-L319 WeakPolarHBondContact O-CA 3.21Å; R99-L319 HydrophobicContact CB-CD2 4.13Å; R99-L319 HydrophobicContact CG-CD2 3.48Å; R99-L319 VanDerWaalsContact CG-CD2 3.48Å; T277-L319 VanDerWaalsContact CA-O 3.31Å; T277-L319 WeakPolarHBondContact CA-O 3.3Å; C278-L319 PolarHBondContact N-O 2.77Å; C278-L319 PolarHBondContact O-N 2.84Å; E280-L319 HydrophobicContact CB-CD1 4.38Å; E280-L319 HydrophobicContact CB-CD2 4.18Å; E280-L319 HydrophobicContact CB-CG 4.01Å; E280-L319 HydrophobicContact CG-CD1 4.34Å; E280-L319 HydrophobicContact CG-CD2 4.29Å; E280-L319 HydrophobicContact CG-CG 4.37Å; I286-L319 HydrophobicContact CD1-CD1 3.52Å; I286-L319 HydrophobicContact CG2-CD1 4.14Å; R289-L319 HydrophobicContact CG-CD1 4.3Å
320	S	98.6	Very high	97.1	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	168.8	178	-159.6	0	0	0	0	112.7	V97 F98 I100 T277 D324 L477	V97-S320 WeakPolarHBondContact CA-O 3.46Å; F98-S320 PolarHBondContact N-O 3.44Å; F98-S320 PolarHBondContact O-N 3.14Å; I100-S320 VanDerWaalsContact CG2-CB 3.49Å; T277-S320 PolarHBondContact OG1-OG 2.9Å; S320-D324 WeakPolarHBondContact OG-CB 3.37Å; S320-L477 WeakPolarHBondContact O-CD1 3.39Å
321	T	98.7	Very high	97.3	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.04	C	C	.	.			trans	-95.8	160.3	164.8	65.3	0	0	0	0	110.6	E94 V97 N276 S323 D324 L325 L477	E94-T321 WeakPolarHBondContact O-CG2 3.42Å; V97-T321 HydrophobicContact CG1-CG2 3.91Å; N276-T321 HydrophobicContact CB-CG2 3.58Å; T321-S323 PolarHBondContact O-N 2.91Å; T321-S323 PolarHBondContact OG1-OG 2.95Å; T321-S323 VanDerWaalsContact OG1-OG 3.05Å; T321-D324 PolarHBondContact O-N 2.87Å; T321-D324 WeakPolarHBondContact OG1-CB 3.36Å; T321-D324 VanDerWaalsContact OG1-CG 3.31Å; T321-D324 PolarHBondContact OG1-N 2.92Å; T321-D324 PolarHBondContact OG1-OD2 2.89Å; T321-L325 PolarHBondContact O-N 3.38Å; T321-L477 VanDerWaalsContact C-CD1 3.4Å
322	A	98.5	Very high	97.5	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-62.1	-36.1	173	0	0	0	0	0	111	C68 L325 I326 A475 L477	C68-A322 HydrophobicContact CB-CB 3.64Å; A322-L325 PolarHBondContact O-N 2.85Å; A322-I326 WeakPolarHBondContact O-CG1 3.24Å; A322-I326 PolarHBondContact O-N 2.82Å; A322-A475 HydrophobicContact CB-CB 4.13Å; A322-L477 HydrophobicContact CB-CD1 4.26Å; A322-L477 HydrophobicContact CB-CG 4.34Å; A322-L477 VanDerWaalsContact N-CD1 3.27Å
323	S	98	Very high	97.6	Very high	5 Å²	5	7.9 Å²	7.9	4%	0.035	4%	0.036	C	C	.	.	H	α-helix	trans	-65.7	-38.8	178.3	75.5	0	0	0	0	113.5	T321 I326 R327	T321-S323 PolarHBondContact O-N 2.91Å; T321-S323 PolarHBondContact OG1-OG 2.95Å; T321-S323 VanDerWaalsContact OG1-OG 3.05Å; S323-I326 PolarHBondContact O-N 2.98Å; S323-R327 WeakPolarHBondContact O-CG 3.17Å; S323-R327 PolarHBondContact O-N 2.79Å; S323-R327 PolarHBondContact OG-NH1 3.41Å
324	D	98.6	Very high	97.6	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-69.7	-36.6	175.8	-72.8	-35.1	0	0	0	111.6	L274 N275 N276 T277 S320 T321 I326 R327 L328	L274-D324 WeakPolarHBondContact CA-OD1 3.22Å; L274-D324 HydrophobicContact CB-CB 4.19Å; L274-D324 HydrophobicContact CD2-CB 4.16Å; L274-D324 VanDerWaalsContact CD2-O 3.26Å; L274-D324 WeakPolarHBondContact CD2-O 3.32Å; N275-D324 PolarHBondContact N-OD1 2.81Å; N276-D324 WeakPolarHBondContact CA-OD2 3.35Å; N276-D324 VanDerWaalsContact CB-OD2 3.25Å; N276-D324 WeakPolarHBondContact CB-OD2 3.45Å; N276-D324 PolarHBondContact N-OD2 2.85Å; T277-D324 PolarHBondContact N-OD2 3.48Å; T277-D324 VanDerWaalsContact OG1-CB 3.26Å; T277-D324 WeakPolarHBondContact OG1-CB 3.38Å; S320-D324 WeakPolarHBondContact OG-CB 3.37Å; T321-D324 PolarHBondContact O-N 2.87Å; T321-D324 WeakPolarHBondContact OG1-CB 3.36Å; T321-D324 VanDerWaalsContact OG1-CG 3.31Å; T321-D324 PolarHBondContact OG1-N 2.92Å; T321-D324 PolarHBondContact OG1-OD2 2.89Å; D324-I326 VanDerWaalsContact C-N 3.28Å; D324-I326 PolarHBondContact O-N 2.83Å; D324-R327 WeakPolarHBondContact O-CB 3.34Å; D324-R327 PolarHBondContact O-N 2.92Å; D324-R327 IonicContact OD1-CZ 2.64Å; D324-R327 IonicContact OD1-NH1 3.12Å; D324-R327 PolarHBondContact OD1-NH1 3.33Å; D324-L328 PolarHBondContact O-N 3Å
325	L	98.8	Very high	97.5	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-65.2	-34.1	173	-66	-171.1	0	0	0	112.4	I100 I103 F107 T321 A322 L328 A329 L408 A475 L477	I100-L325 HydrophobicContact CD1-CD2 3.95Å; I100-L325 HydrophobicContact CG2-CD1 4.17Å; I103-L325 HydrophobicContact CD1-CD1 4.03Å; I103-L325 HydrophobicContact CG2-CD1 4.2Å; I103-L325 HydrophobicContact CG2-CD2 4.03Å; F107-L325 HydrophobicContact CE2-CD2 4.13Å; F107-L325 HydrophobicContact CZ-CD2 4.09Å; T321-L325 PolarHBondContact O-N 3.38Å; A322-L325 PolarHBondContact O-N 2.85Å; L325-L328 WeakPolarHBondContact O-CB 3.48Å; L325-L328 PolarHBondContact O-N 3.12Å; L325-A329 WeakPolarHBondContact O-CB 3.41Å; L325-A329 PolarHBondContact O-N 3.5Å; L325-L408 HydrophobicContact CB-CD1 4.03Å; L325-A475 HydrophobicContact CB-CB 3.89Å; L325-A475 HydrophobicContact CD1-CB 4.4Å; L325-L477 HydrophobicContact CD1-CD2 3.74Å
326	I	98.5	Very high	97.4	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-65.9	-40.9	171.8	-71.6	-60.1	0	0	0	111.5	C68 S70 I75 A322 S323 D324 L328 A329 D330 N473 A475	C68-I326 HydrophobicContact CB-CG1 3.69Å; S70-I326 WeakPolarHBondContact OG-CG2 3.34Å; I75-I326 HydrophobicContact CG1-CG2 4.17Å; A322-I326 WeakPolarHBondContact O-CG1 3.24Å; A322-I326 PolarHBondContact O-N 2.82Å; S323-I326 PolarHBondContact O-N 2.98Å; D324-I326 VanDerWaalsContact C-N 3.28Å; D324-I326 PolarHBondContact O-N 2.83Å; I326-L328 VanDerWaalsContact C-N 3.34Å; I326-L328 PolarHBondContact O-N 2.98Å; I326-A329 PolarHBondContact O-N 3.24Å; I326-A329 VanDerWaalsContact O-N 3.1Å; I326-D330 WeakPolarHBondContact CG2-OD2 3.3Å; I326-D330 WeakPolarHBondContact O-CB 3.49Å; I326-D330 VanDerWaalsContact O-CG 3.28Å; I326-D330 PolarHBondContact O-N 2.9Å; I326-N473 VanDerWaalsContact CD1-C 3.44Å; I326-N473 HydrophobicContact CD1-CB 3.73Å; I326-N473 VanDerWaalsContact CD1-O 3.28Å; I326-N473 WeakPolarHBondContact CD1-O 3.39Å; I326-A475 HydrophobicContact CD1-CB 4.08Å; I326-A475 HydrophobicContact CG1-CB 4.03Å
327	R	98.1	Very high	97.3	Very high	82 Å²	82	11.4 Å²	11.4	31%	0.309	5%	0.05	S	C	.	.	H	α-helix	trans	-58.6	-44.3	173.3	-69.8	176.9	-173	92.4	12.9	112.2	N273 L274 S323 D324 H331	N273-R327 WeakPolarHBondContact O-CD 3.4Å; L274-R327 HydrophobicContact CD2-CB 3.74Å; S323-R327 WeakPolarHBondContact O-CG 3.17Å; S323-R327 PolarHBondContact O-N 2.79Å; S323-R327 PolarHBondContact OG-NH1 3.41Å; D324-R327 WeakPolarHBondContact O-CB 3.34Å; D324-R327 PolarHBondContact O-N 2.92Å; D324-R327 IonicContact OD1-CZ 2.64Å; D324-R327 IonicContact OD1-NH1 3.12Å; D324-R327 PolarHBondContact OD1-NH1 3.33Å; R327-H331 WeakPolarHBondContact O-CB 3.45Å; R327-H331 PolarHBondContact O-N 3.47Å
328	L	98.3	Very high	97.2	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-57.6	-49.3	172.3	167.8	68.6	0	0	0	110.8	F107 L110 L272 D324 L325 I326 H331 L332 L408	F107-L328 HydrophobicContact CD2-CD2 4.38Å; F107-L328 HydrophobicContact CE1-CD2 4.04Å; F107-L328 HydrophobicContact CE2-CD2 3.76Å; F107-L328 HydrophobicContact CZ-CD2 3.6Å; L110-L328 HydrophobicContact CD1-CD1 3.64Å; L272-L328 HydrophobicContact CD1-CD1 3.64Å; D324-L328 PolarHBondContact O-N 3Å; L325-L328 WeakPolarHBondContact O-CB 3.48Å; L325-L328 PolarHBondContact O-N 3.12Å; I326-L328 VanDerWaalsContact C-N 3.34Å; I326-L328 PolarHBondContact O-N 2.98Å; L328-H331 PolarHBondContact O-N 2.73Å; L328-L332 HydrophobicContact CD1-CD1 3.92Å; L328-L332 HydrophobicContact CD1-CG 4.23Å; L328-L332 HydrophobicContact CG-CD1 4.18Å; L328-L332 WeakPolarHBondContact O-CG 3.34Å; L328-L332 PolarHBondContact O-N 3.47Å; L328-L332 VanDerWaalsContact O-N 3.11Å; L328-L408 HydrophobicContact CD2-CD2 4.15Å
329	A	98.5	Very high	96.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.5	-44.7	-177.4	0	0	0	0	0	112.8	L325 I326 H331 L332 A333 L408 L410 N473	L325-A329 WeakPolarHBondContact O-CB 3.41Å; L325-A329 PolarHBondContact O-N 3.5Å; I326-A329 PolarHBondContact O-N 3.24Å; I326-A329 VanDerWaalsContact O-N 3.1Å; A329-H331 VanDerWaalsContact C-N 3.34Å; A329-H331 PolarHBondContact O-N 2.79Å; A329-L332 PolarHBondContact O-N 3.18Å; A329-A333 VanDerWaalsContact O-CB 3.28Å; A329-A333 WeakPolarHBondContact O-CB 3.15Å; A329-A333 PolarHBondContact O-N 2.9Å; A329-L408 HydrophobicContact CB-CD1 4.1Å; A329-L410 HydrophobicContact CB-CD1 4.16Å; A329-L410 HydrophobicContact CB-CD2 4.01Å; A329-L410 HydrophobicContact CB-CG 3.83Å; A329-L410 WeakPolarHBondContact O-CD2 3.23Å; A329-N473 HydrophobicContact CB-CB 3.68Å
330	D	97.8	Very high	96.4	Very high	14 Å²	14	20.4 Å²	20.4	8%	0.075	9%	0.094	C	C	.	.	H	α-helix	trans	-60.9	-43.9	176.6	-69.8	-27.8	0	0	0	111	S70 I326 L332 A333 F334 N473	S70-D330 WeakPolarHBondContact CB-OD1 3.27Å; S70-D330 PolarHBondContact OG-OD1 2.88Å; S70-D330 PolarHBondContact OG-OD2 3.05Å; I326-D330 WeakPolarHBondContact CG2-OD2 3.3Å; I326-D330 WeakPolarHBondContact O-CB 3.49Å; I326-D330 VanDerWaalsContact O-CG 3.28Å; I326-D330 PolarHBondContact O-N 2.9Å; D330-L332 VanDerWaalsContact C-N 3.35Å; D330-L332 PolarHBondContact O-N 3.44Å; D330-A333 PolarHBondContact O-N 3.5Å; D330-F334 WeakPolarHBondContact O-CB 3.49Å; D330-F334 WeakPolarHBondContact O-CD1 3.14Å; D330-F334 WeakPolarHBondContact O-CD2 3.4Å; D330-F334 WeakPolarHBondContact O-CG 3.33Å; D330-F334 PolarHBondContact O-N 3.17Å; D330-N473 PolarHBondContact N-ND2 3.45Å; D330-N473 PolarHBondContact OD1-ND2 3.15Å
331	H	97.5	Very high	95.2	Very high	33 Å²	33	27.1 Å²	27.1	15%	0.153	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-45.4	176.6	-167.5	95.9	0	0	0	112.1	L272 R327 L328 A329 F334 I335 Y343 I345	L272-H331 HydrophobicContact CD2-CB 4.07Å; R327-H331 WeakPolarHBondContact O-CB 3.45Å; R327-H331 PolarHBondContact O-N 3.47Å; L328-H331 PolarHBondContact O-N 2.73Å; A329-H331 VanDerWaalsContact C-N 3.34Å; A329-H331 PolarHBondContact O-N 2.79Å; H331-F334 PolarHBondContact O-N 3.05Å; H331-I335 WeakPolarHBondContact O-CG1 3.46Å; H331-I335 PolarHBondContact O-N 3.18Å; H331-I335 VanDerWaalsContact O-N 3.08Å; H331-Y343 PolarHBondContact CE1-O 3.08Å; H331-I345 PolarHBondContact NE2-N 3.04Å
332	L	97.5	Very high	94.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-70.4	-40.1	178.8	-64	175.2	0	0	0	112.4	L110 L328 A329 D330 F334 I335 Y336 I345 L351 W356 W373 L410	L110-L332 HydrophobicContact CD1-CD1 4.39Å; L110-L332 HydrophobicContact CD1-CD2 4.02Å; L110-L332 HydrophobicContact CD2-CD2 3.53Å; L110-L332 HydrophobicContact CG-CD2 4.4Å; L328-L332 HydrophobicContact CD1-CD1 3.92Å; L328-L332 HydrophobicContact CD1-CG 4.23Å; L328-L332 HydrophobicContact CG-CD1 4.18Å; L328-L332 WeakPolarHBondContact O-CG 3.34Å; L328-L332 PolarHBondContact O-N 3.47Å; L328-L332 VanDerWaalsContact O-N 3.11Å; A329-L332 PolarHBondContact O-N 3.18Å; D330-L332 VanDerWaalsContact C-N 3.35Å; D330-L332 PolarHBondContact O-N 3.44Å; L332-F334 VanDerWaalsContact C-N 3.28Å; L332-F334 PolarHBondContact O-N 2.99Å; L332-I335 HydrophobicContact CD2-CD1 4.43Å; L332-I335 PolarHBondContact O-N 3.23Å; L332-Y336 WeakPolarHBondContact O-CB 3.41Å; L332-Y336 PolarHBondContact O-N 2.96Å; L332-I345 HydrophobicContact CD2-CG2 4.31Å; L332-L351 HydrophobicContact CB-CD2 4.49Å; L332-L351 HydrophobicContact CD2-CD1 4.24Å; L332-L351 WeakPolarHBondContact O-CD2 3.38Å; L332-W356 HydrophobicContact CB-CH2 4Å; L332-W356 HydrophobicContact CB-CZ2 4.03Å; L332-W356 HydrophobicContact CD1-CZ2 4.28Å; L332-W373 HydrophobicContact CD1-CH2 3.27Å; L332-W373 HydrophobicContact CD1-CZ2 3.44Å; L332-W373 VanDerWaalsContact CD1-CZ2 3.44Å; L332-W373 HydrophobicContact CD1-CZ3 4.41Å; L332-L410 HydrophobicContact CB-CD2 4.17Å
333	A	96.5	Very high	93.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-43.1	174.7	0	0	0	0	0	110.8	A329 D330 Y336 M337 L412 P471	A329-A333 VanDerWaalsContact O-CB 3.28Å; A329-A333 WeakPolarHBondContact O-CB 3.15Å; A329-A333 PolarHBondContact O-N 2.9Å; D330-A333 PolarHBondContact O-N 3.5Å; A333-Y336 WeakPolarHBondContact O-CB 3.4Å; A333-Y336 PolarHBondContact O-N 3.45Å; A333-M337 VanDerWaalsContact O-CG 3.25Å; A333-M337 WeakPolarHBondContact O-CG 3.33Å; A333-M337 PolarHBondContact O-N 3.05Å; A333-L412 HydrophobicContact CB-CD2 3.65Å; A333-P471 HydrophobicContact CB-CB 3.62Å; A333-P471 HydrophobicContact CB-CG 3.78Å
334	F	95.5	Very high	92.9	Very high	48 Å²	48	41 Å²	41	21%	0.211	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-36	177.7	-65.2	-13.5	0	0	0	113.2	D330 H331 L332 M337 G338 W339 L340	D330-F334 WeakPolarHBondContact O-CB 3.49Å; D330-F334 WeakPolarHBondContact O-CD1 3.14Å; D330-F334 WeakPolarHBondContact O-CD2 3.4Å; D330-F334 WeakPolarHBondContact O-CG 3.33Å; D330-F334 PolarHBondContact O-N 3.17Å; H331-F334 PolarHBondContact O-N 3.05Å; L332-F334 VanDerWaalsContact C-N 3.28Å; L332-F334 PolarHBondContact O-N 2.99Å; F334-M337 PolarHBondContact O-N 3.42Å; F334-G338 PolarHBondContact O-N 3.34Å; F334-W339 HydrophobicContact CB-CB 4.26Å; F334-W339 HydrophobicContact CD1-CD2 4.49Å; F334-W339 AromaticContact CD1-CE3 3.36Å; F334-W339 HydrophobicContact CD1-CE3 3.36Å; F334-W339 AromaticContact CD1-CZ3 3.68Å; F334-W339 HydrophobicContact CD1-CZ3 3.68Å; F334-W339 AromaticContact CE1-CE3 3.66Å; F334-W339 HydrophobicContact CE1-CE3 3.66Å; F334-W339 AromaticContact CE1-CZ3 3.6Å; F334-W339 HydrophobicContact CE1-CZ3 3.6Å; F334-W339 HydrophobicContact CG-CE3 4.08Å; F334-W339 PolarHBondContact O-N 3.06Å; F334-L340 HydrophobicContact CB-CB 4.42Å; F334-L340 HydrophobicContact CB-CD1 3.55Å; F334-L340 HydrophobicContact CB-CG 3.68Å; F334-L340 HydrophobicContact CD2-CD1 4.04Å; F334-L340 HydrophobicContact CD2-CG 4.44Å; F334-L340 HydrophobicContact CG-CD1 4.33Å; F334-L340 PolarHBondContact O-N 3.48Å
335	I	95.6	Very high	92.7	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-49.2	169.5	-68.8	167.5	0	0	0	110	H331 L332 M337 G338 L340 I345 V346 Q348 L351	H331-I335 WeakPolarHBondContact O-CG1 3.46Å; H331-I335 PolarHBondContact O-N 3.18Å; H331-I335 VanDerWaalsContact O-N 3.08Å; L332-I335 HydrophobicContact CD2-CD1 4.43Å; L332-I335 PolarHBondContact O-N 3.23Å; I335-M337 VanDerWaalsContact C-N 3.29Å; I335-M337 PolarHBondContact O-N 3.41Å; I335-G338 PolarHBondContact O-N 3.27Å; I335-L340 HydrophobicContact CG1-CB 4.04Å; I335-I345 HydrophobicContact CD1-CG2 3.94Å; I335-V346 HydrophobicContact CD1-CG2 4.37Å; I335-Q348 HydrophobicContact CG2-CB 4.27Å; I335-Q348 VanDerWaalsContact O-CG 3.28Å; I335-Q348 WeakPolarHBondContact O-CG 3.25Å; I335-L351 HydrophobicContact CB-CD2 3.91Å; I335-L351 HydrophobicContact CG2-CB 4.1Å; I335-L351 HydrophobicContact CG2-CD2 3.66Å
336	Y	94.9	Very high	92.5	Very high	12 Å²	12	41.3 Å²	41.3	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-56.3	-44.3	179.3	169.9	-91.1	0	0	0	111.3	L332 A333 G338 Q348 N352 W356 L393 L412 P413 L415	L332-Y336 WeakPolarHBondContact O-CB 3.41Å; L332-Y336 PolarHBondContact O-N 2.96Å; A333-Y336 WeakPolarHBondContact O-CB 3.4Å; A333-Y336 PolarHBondContact O-N 3.45Å; Y336-G338 PolarHBondContact O-N 3.18Å; Y336-Q348 PolarHBondContact O-NE2 3.33Å; Y336-N352 WeakPolarHBondContact CD2-OD1 3.18Å; Y336-W356 AromaticContact CD2-CE3 3.79Å; Y336-W356 HydrophobicContact CD2-CE3 3.79Å; Y336-W356 AromaticContact CD2-CZ3 3.66Å; Y336-W356 HydrophobicContact CD2-CZ3 3.66Å; Y336-W356 HydrophobicContact CE2-CE3 4.48Å; Y336-W356 HydrophobicContact CG-CE3 4.42Å; Y336-W356 AromaticContact CG-CZ3 3.83Å; Y336-W356 HydrophobicContact CG-CZ3 3.83Å; Y336-L393 HydrophobicContact CE2-CD2 3.94Å; Y336-L412 HydrophobicContact CD1-CB 4.31Å; Y336-L412 HydrophobicContact CD1-CD1 4.03Å; Y336-L412 HydrophobicContact CD2-CD1 4.37Å; Y336-L412 HydrophobicContact CE1-CB 3.94Å; Y336-L412 HydrophobicContact CE1-CD1 4.27Å; Y336-L412 HydrophobicContact CG-CD1 4.09Å; Y336-P413 WeakPolarHBondContact CE1-O 3.26Å; Y336-P413 PolarHBondContact OH-O 3.16Å; Y336-L415 HydrophobicContact CD1-CD1 4.33Å; Y336-L415 HydrophobicContact CD1-CG 4.44Å; Y336-L415 HydrophobicContact CD2-CD1 4.29Å; Y336-L415 HydrophobicContact CE1-CD1 4.01Å; Y336-L415 HydrophobicContact CE1-CD2 4.06Å; Y336-L415 HydrophobicContact CE1-CG 3.73Å; Y336-L415 HydrophobicContact CE2-CD1 3.95Å; Y336-L415 HydrophobicContact CE2-CG 4.26Å; Y336-L415 HydrophobicContact CG-CD1 4.46Å; Y336-L415 VanDerWaalsContact O-CD1 3.25Å; Y336-L415 WeakPolarHBondContact O-CD1 3.41Å; Y336-L415 PolarHBondContact OH-N 3.41Å
337	M	93.2	Very high	92.4	Very high	42 Å²	42	46.5 Å²	46.5	21%	0.207	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.3	176.8	-64.3	-53.5	-66	0	0	114.5	A333 F334 I335 W339 P413 L415 P471	A333-M337 VanDerWaalsContact O-CG 3.25Å; A333-M337 WeakPolarHBondContact O-CG 3.33Å; A333-M337 PolarHBondContact O-N 3.05Å; F334-M337 PolarHBondContact O-N 3.42Å; I335-M337 VanDerWaalsContact C-N 3.29Å; I335-M337 PolarHBondContact O-N 3.41Å; M337-W339 VanDerWaalsContact C-N 3.33Å; M337-W339 HydrophobicContact CB-CD2 3.67Å; M337-W339 HydrophobicContact CB-CE3 4.27Å; M337-W339 HydrophobicContact CB-CG 3.88Å; M337-W339 HydrophobicContact CB-CZ2 4.03Å; M337-W339 HydrophobicContact CE-CZ2 3.97Å; M337-W339 HydrophobicContact CG-CD2 4.37Å; M337-W339 HydrophobicContact CG-CH2 4.34Å; M337-W339 HydrophobicContact CG-CZ2 4.12Å; M337-P413 HydrophobicContact CE-CG 3.73Å; M337-P413 HydrophobicContact SD-CG 3.49Å; M337-P413 WeakPolarHBondContact SD-CG 3.43Å; M337-L415 HydrophobicContact CE-CD2 4.34Å; M337-L415 HydrophobicContact SD-CD2 4.12Å; M337-P471 HydrophobicContact CG-CG 3.9Å; M337-P471 HydrophobicContact SD-CG 4.38Å
338	G	91.6	Very high	92.2	Very high	23 Å²	23	45.2 Å²	45.2	24%	0.237	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	13	-176.6	0	0	0	0	0	114	F334 I335 Y336 Q348	F334-G338 PolarHBondContact O-N 3.34Å; I335-G338 PolarHBondContact O-N 3.27Å; Y336-G338 PolarHBondContact O-N 3.18Å; G338-Q348 VanDerWaalsContact N-NE2 3.19Å
339	W	91.8	Very high	92	Very high	129 Å²	129	47.8 Å²	47.8	49%	0.489	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-12.4	-177.3	-57.2	-12.5	0	0	0	113.3	F334 M337	F334-W339 HydrophobicContact CB-CB 4.26Å; F334-W339 HydrophobicContact CD1-CD2 4.49Å; F334-W339 AromaticContact CD1-CE3 3.36Å; F334-W339 HydrophobicContact CD1-CE3 3.36Å; F334-W339 AromaticContact CD1-CZ3 3.68Å; F334-W339 HydrophobicContact CD1-CZ3 3.68Å; F334-W339 AromaticContact CE1-CE3 3.66Å; F334-W339 HydrophobicContact CE1-CE3 3.66Å; F334-W339 AromaticContact CE1-CZ3 3.6Å; F334-W339 HydrophobicContact CE1-CZ3 3.6Å; F334-W339 HydrophobicContact CG-CE3 4.08Å; F334-W339 PolarHBondContact O-N 3.06Å; M337-W339 VanDerWaalsContact C-N 3.33Å; M337-W339 HydrophobicContact CB-CD2 3.67Å; M337-W339 HydrophobicContact CB-CE3 4.27Å; M337-W339 HydrophobicContact CB-CG 3.88Å; M337-W339 HydrophobicContact CB-CZ2 4.03Å; M337-W339 HydrophobicContact CE-CZ2 3.97Å; M337-W339 HydrophobicContact CG-CD2 4.37Å; M337-W339 HydrophobicContact CG-CH2 4.34Å; M337-W339 HydrophobicContact CG-CZ2 4.12Å
340	L	87.6	Confident	91.8	Very high	39 Å²	39	48.2 Å²	48.2	20%	0.204	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	47.8	-177.7	-71.4	-178.3	0	0	0	113.3	F334 I335 G344	F334-L340 HydrophobicContact CB-CB 4.42Å; F334-L340 HydrophobicContact CB-CD1 3.55Å; F334-L340 HydrophobicContact CB-CG 3.68Å; F334-L340 HydrophobicContact CD2-CD1 4.04Å; F334-L340 HydrophobicContact CD2-CG 4.44Å; F334-L340 HydrophobicContact CG-CD1 4.33Å; F334-L340 PolarHBondContact O-N 3.48Å; I335-L340 HydrophobicContact CG1-CB 4.04Å; L340-G344 WeakPolarHBondContact O-CA 3.27Å; L340-G344 PolarHBondContact O-N 3.38Å
341	E	73.1	Confident	91.8	Very high	141 Å²	141	47.5 Å²	47.5	66%	0.659	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-51.5	-177.1	-71.1	-173.9	172.7	0	0	113.8
342	S	75.9	Confident	91.5	Very high	110 Å²	110	47.8 Å²	47.8	77%	0.769	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-14	-175.2	-63.3	0	0	0	0	114.3
343	Y	82.1	Confident	91.2	Very high	176 Å²	176	52.6 Å²	52.6	69%	0.69	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	4.2	-175.4	-59.2	-78.9	0	0	0	112.7	Y271 H331	Y271-Y343 PolarHBondContact OH-O 3.27Å; H331-Y343 PolarHBondContact CE1-O 3.08Å
344	G	89.2	Confident	91	Very high	11 Å²	11	55.1 Å²	55.1	11%	0.113	28%	0.276	C	S	.	.			trans	-66	145.6	174.9	0	0	0	0	0	111.1	Y271 L340 V346	Y271-G344 PolarHBondContact OH-O 3.12Å; L340-G344 WeakPolarHBondContact O-CA 3.27Å; L340-G344 PolarHBondContact O-N 3.38Å; G344-V346 PolarHBondContact O-N 3.15Å
345	I	94.6	Very high	91.1	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.266	C	S	.	.	S	Bend	trans	-64	-29.6	172.8	-177.9	62.5	0	0	0	110.8	L110 R114 F230 L268 Y271 L272 H331 L332 I335	L110-I345 HydrophobicContact CD1-CG2 4.34Å; L110-I345 HydrophobicContact CD2-CG2 4.1Å; R114-I345 PolarHBondContact NH1-O 3.09Å; R114-I345 VanDerWaalsContact NH1-O 3.15Å; F230-I345 HydrophobicContact CE1-CD1 3.88Å; F230-I345 HydrophobicContact CZ-CD1 4.3Å; L268-I345 HydrophobicContact CD1-CD1 3.59Å; L268-I345 HydrophobicContact CD1-CG1 3.62Å; Y271-I345 HydrophobicContact CD1-CB 4.18Å; Y271-I345 HydrophobicContact CD1-CD1 3.61Å; Y271-I345 HydrophobicContact CD1-CG1 4.38Å; Y271-I345 HydrophobicContact CE1-CB 3.79Å; Y271-I345 HydrophobicContact CE1-CD1 3.77Å; Y271-I345 HydrophobicContact CE1-CG1 4.36Å; Y271-I345 HydrophobicContact CG-CD1 4.02Å; L272-I345 HydrophobicContact CD2-CB 4.47Å; H331-I345 PolarHBondContact NE2-N 3.04Å; L332-I345 HydrophobicContact CD2-CG2 4.31Å; I335-I345 HydrophobicContact CD1-CG2 3.94Å
346	V	95.5	Very high	91	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.024	27%	0.268	C	S	.	.	S	Bend	trans	-136.4	161.7	173.2	-61.5	0	0	0	0	109.3	L110 D117 I335 G344 T350 L351	L110-V346 HydrophobicContact CD2-CG2 4.43Å; D117-V346 WeakPolarHBondContact OD2-CA 3.44Å; D117-V346 WeakPolarHBondContact OD2-CB 3.22Å; I335-V346 HydrophobicContact CD1-CG2 4.37Å; G344-V346 PolarHBondContact O-N 3.15Å; V346-T350 HydrophobicContact CB-CG2 4.17Å; V346-T350 HydrophobicContact CG1-CG2 4.49Å; V346-L351 HydrophobicContact CG2-CB 4.13Å
347	K	95	Very high	90.9	Very high	108 Å²	108	58.5 Å²	58.5	47%	0.47	29%	0.29	S	S	.	.			trans	-65.5	152.3	171.1	-64.9	175.4	-167.6	159.6	0	111.1	D117 S349 T350 L351	D117-K347 VanDerWaalsContact OD1-CD 3.29Å; D117-K347 WeakPolarHBondContact OD1-CD 3.5Å; D117-K347 WeakPolarHBondContact OD1-CG 3.26Å; D117-K347 IonicContact OD1-NZ 3.95Å; D117-K347 PolarHBondContact OD2-N 3.2Å; K347-S349 VanDerWaalsContact C-N 3.3Å; K347-S349 PolarHBondContact O-N 2.96Å; K347-T350 WeakPolarHBondContact O-CB 3.39Å; K347-T350 PolarHBondContact O-N 2.57Å; K347-T350 VanDerWaalsContact O-N 3.15Å; K347-L351 PolarHBondContact O-N 3.32Å
348	Q	94.3	Very high	90.7	Very high	56 Å²	56	58 Å²	58	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-57.2	-41.8	173.9	-177.3	-174.3	39	0	0	112.2	I335 Y336 G338 T350 L351 N352	I335-Q348 HydrophobicContact CG2-CB 4.27Å; I335-Q348 VanDerWaalsContact O-CG 3.28Å; I335-Q348 WeakPolarHBondContact O-CG 3.25Å; Y336-Q348 PolarHBondContact O-NE2 3.33Å; G338-Q348 VanDerWaalsContact N-NE2 3.19Å; Q348-T350 PolarHBondContact O-N 3.45Å; Q348-L351 PolarHBondContact O-N 3.32Å; Q348-N352 WeakPolarHBondContact O-CB 3.36Å; Q348-N352 PolarHBondContact O-N 3.12Å; Q348-N352 PolarHBondContact O-OD1 2.78Å
349	S	93.8	Very high	90.3	Very high	54 Å²	54	58.7 Å²	58.7	38%	0.378	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-41	176.6	55.4	0	0	0	0	112.2	K347 L351 Q353	K347-S349 VanDerWaalsContact C-N 3.3Å; K347-S349 PolarHBondContact O-N 2.96Å; S349-L351 VanDerWaalsContact C-N 3.35Å; S349-L351 PolarHBondContact O-N 3.01Å; S349-Q353 WeakPolarHBondContact O-CA 3.27Å; S349-Q353 WeakPolarHBondContact O-CB 3.11Å; S349-Q353 PolarHBondContact O-N 3.4Å
350	T	95.6	Very high	89.8	Confident	8 Å²	8	53.9 Å²	53.9	5%	0.049	28%	0.276	C	S	.	.	I	π-helix	trans	-63.3	-41.6	175.8	-64.1	0	0	0	0	111.4	D117 V346 K347 Q348 L354 L355	D117-T350 PolarHBondContact OD1-OG1 2.73Å; V346-T350 HydrophobicContact CB-CG2 4.17Å; V346-T350 HydrophobicContact CG1-CG2 4.49Å; K347-T350 WeakPolarHBondContact O-CB 3.39Å; K347-T350 PolarHBondContact O-N 2.57Å; K347-T350 VanDerWaalsContact O-N 3.15Å; Q348-T350 PolarHBondContact O-N 3.45Å; T350-L354 HydrophobicContact CG2-CD1 4.46Å; T350-L354 WeakPolarHBondContact O-CB 3.49Å; T350-L354 PolarHBondContact O-N 3.28Å; T350-L355 PolarHBondContact O-N 3.18Å
351	L	96	Very high	89.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.291	C	S	.	.	I	π-helix	trans	-64.2	-56.9	174.9	-172.5	64	0	0	0	111.3	L332 I335 V346 K347 Q348 S349 L355 W356	L332-L351 HydrophobicContact CB-CD2 4.49Å; L332-L351 HydrophobicContact CD2-CD1 4.24Å; L332-L351 WeakPolarHBondContact O-CD2 3.38Å; I335-L351 HydrophobicContact CB-CD2 3.91Å; I335-L351 HydrophobicContact CG2-CB 4.1Å; I335-L351 HydrophobicContact CG2-CD2 3.66Å; V346-L351 HydrophobicContact CG2-CB 4.13Å; K347-L351 PolarHBondContact O-N 3.32Å; Q348-L351 PolarHBondContact O-N 3.32Å; S349-L351 VanDerWaalsContact C-N 3.35Å; S349-L351 PolarHBondContact O-N 3.01Å; L351-L355 HydrophobicContact CD1-CB 4.42Å; L351-L355 HydrophobicContact CD1-CD1 4.38Å; L351-L355 PolarHBondContact O-N 2.92Å; L351-W356 HydrophobicContact CD1-CD2 3.88Å; L351-W356 HydrophobicContact CD1-CE3 4.34Å; L351-W356 HydrophobicContact CD1-CG 4.26Å; L351-W356 HydrophobicContact CD1-CH2 4.45Å; L351-W356 HydrophobicContact CD1-CZ2 4.01Å; L351-W356 HydrophobicContact CD2-CE3 4.21Å; L351-W356 HydrophobicContact CD2-CH2 4.03Å; L351-W356 HydrophobicContact CD2-CZ2 4.4Å; L351-W356 HydrophobicContact CD2-CZ3 3.93Å; L351-W356 HydrophobicContact CG-CD2 3.98Å; L351-W356 HydrophobicContact CG-CE3 3.98Å; L351-W356 HydrophobicContact CG-CH2 4.45Å; L351-W356 HydrophobicContact CG-CZ2 4.48Å; L351-W356 HydrophobicContact CG-CZ3 4.21Å; L351-W356 WeakPolarHBondContact O-CB 3.15Å; L351-W356 PolarHBondContact O-N 2.77Å
352	N	91.7	Very high	89.5	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.203	26%	0.261	C	S	.	.	I	π-helix	trans	-78.4	-40.4	-167.2	-62.7	5.5	0	0	0	112.8	Y336 Q348 L415	Y336-N352 WeakPolarHBondContact CD2-OD1 3.18Å; Q348-N352 WeakPolarHBondContact O-CB 3.36Å; Q348-N352 PolarHBondContact O-N 3.12Å; Q348-N352 PolarHBondContact O-OD1 2.78Å; N352-L415 WeakPolarHBondContact ND2-CD1 3.3Å
353	Q	91.4	Very high	89.3	Confident	102 Å²	102	50.1 Å²	50.1	48%	0.477	26%	0.261	S	S	.	.	I	π-helix	trans	-93.8	-14.5	-172.8	-54.9	176	0.3	0	0	113.1	S349 K357	S349-Q353 WeakPolarHBondContact O-CA 3.27Å; S349-Q353 WeakPolarHBondContact O-CB 3.11Å; S349-Q353 PolarHBondContact O-N 3.4Å; Q353-K357 WeakPolarHBondContact O-CB 3.26Å; Q353-K357 WeakPolarHBondContact O-CD 3.39Å
354	L	93.6	Very high	88.6	Confident	53 Å²	53	44.5 Å²	44.5	28%	0.277	24%	0.243	S	C	.	.	I	π-helix	trans	-121	-65.8	179.4	-54.9	174	0	0	0	112.1	L116 L123 T350 K357	L116-L354 HydrophobicContact CD1-CD1 4.22Å; L123-L354 HydrophobicContact CD1-CD2 4.37Å; T350-L354 HydrophobicContact CG2-CD1 4.46Å; T350-L354 WeakPolarHBondContact O-CB 3.49Å; T350-L354 PolarHBondContact O-N 3.28Å; L354-K357 PolarHBondContact O-N 3.3Å
355	L	96.1	Very high	87.4	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	I	π-helix	trans	-68.1	-41.1	-171.2	-58.6	-173.7	0	0	0	112.9	L110 T350 L351 L371	L110-L355 HydrophobicContact CD2-CD1 4.12Å; T350-L355 PolarHBondContact O-N 3.18Å; L351-L355 HydrophobicContact CD1-CB 4.42Å; L351-L355 HydrophobicContact CD1-CD1 4.38Å; L351-L355 PolarHBondContact O-N 2.92Å; L355-L371 HydrophobicContact CD2-CB 4.15Å; L355-L371 HydrophobicContact CD2-CD1 4.35Å; L355-L371 PolarHBondContact O-N 3.46Å
356	W	94.9	Very high	86.2	Confident	14 Å²	14	55.9 Å²	55.9	5%	0.053	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	25.3	177.7	-66.6	-6.9	0	0	0	113	L332 Y336 L351 W373 L375 L393 A395 L410 L412	L332-W356 HydrophobicContact CB-CH2 4Å; L332-W356 HydrophobicContact CB-CZ2 4.03Å; L332-W356 HydrophobicContact CD1-CZ2 4.28Å; Y336-W356 AromaticContact CD2-CE3 3.79Å; Y336-W356 HydrophobicContact CD2-CE3 3.79Å; Y336-W356 AromaticContact CD2-CZ3 3.66Å; Y336-W356 HydrophobicContact CD2-CZ3 3.66Å; Y336-W356 HydrophobicContact CE2-CE3 4.48Å; Y336-W356 HydrophobicContact CG-CE3 4.42Å; Y336-W356 AromaticContact CG-CZ3 3.83Å; Y336-W356 HydrophobicContact CG-CZ3 3.83Å; L351-W356 HydrophobicContact CD1-CD2 3.88Å; L351-W356 HydrophobicContact CD1-CE3 4.34Å; L351-W356 HydrophobicContact CD1-CG 4.26Å; L351-W356 HydrophobicContact CD1-CH2 4.45Å; L351-W356 HydrophobicContact CD1-CZ2 4.01Å; L351-W356 HydrophobicContact CD2-CE3 4.21Å; L351-W356 HydrophobicContact CD2-CH2 4.03Å; L351-W356 HydrophobicContact CD2-CZ2 4.4Å; L351-W356 HydrophobicContact CD2-CZ3 3.93Å; L351-W356 HydrophobicContact CG-CD2 3.98Å; L351-W356 HydrophobicContact CG-CE3 3.98Å; L351-W356 HydrophobicContact CG-CH2 4.45Å; L351-W356 HydrophobicContact CG-CZ2 4.48Å; L351-W356 HydrophobicContact CG-CZ3 4.21Å; L351-W356 WeakPolarHBondContact O-CB 3.15Å; L351-W356 PolarHBondContact O-N 2.77Å; W356-W373 AromaticContact CD1-CD1 3.71Å; W356-W373 AromaticContact CD1-CG 3.64Å; W356-W373 AromaticContact NE1-CD1 3.69Å; W356-W373 AromaticContact NE1-CD2 3.33Å; W356-W373 VanDerWaalsContact NE1-CD2 3.33Å; W356-W373 AromaticContact NE1-CE2 3.48Å; W356-W373 AromaticContact NE1-CE3 3.81Å; W356-W373 AromaticContact NE1-CG 3.5Å; W356-W373 AromaticContact NE1-NE1 3.7Å; W356-L375 VanDerWaalsContact C-CD1 3.45Å; W356-L375 HydrophobicContact CB-CD2 3.96Å; W356-L375 HydrophobicContact CG-CD2 4.1Å; W356-L375 WeakPolarHBondContact O-CD1 3.23Å; W356-L393 HydrophobicContact CE3-CD2 4.48Å; W356-A395 HydrophobicContact CD2-CB 4.04Å; W356-A395 HydrophobicContact CE3-CB 4.34Å; W356-A395 HydrophobicContact CH2-CB 4.18Å; W356-A395 HydrophobicContact CZ2-CB 3.84Å; W356-A395 HydrophobicContact CZ3-CB 4.4Å; W356-L410 HydrophobicContact CH2-CD2 3.82Å; W356-L410 HydrophobicContact CZ2-CD2 4.03Å; W356-L412 HydrophobicContact CE3-CD1 4.21Å; W356-L412 HydrophobicContact CH2-CD1 3.7Å; W356-L412 HydrophobicContact CZ3-CD1 3.31Å
357	K	91.4	Very high	85.2	Confident	119 Å²	119	56.2 Å²	56.2	52%	0.517	29%	0.291	S	S	.	.	S	Bend	trans	-92.9	130.9	165	-177	172.5	178.4	176.5	0	109.2	Q353 L354 S359 G370	Q353-K357 WeakPolarHBondContact O-CB 3.26Å; Q353-K357 WeakPolarHBondContact O-CD 3.39Å; L354-K357 PolarHBondContact O-N 3.3Å; K357-S359 PolarHBondContact O-N 2.75Å; K357-G370 WeakPolarHBondContact O-CA 3.45Å
358	V	89.4	Confident	84.9	Confident	32 Å²	32	51.2 Å²	51.2	19%	0.194	27%	0.269	C	S	.	.			trans	-57.3	127.1	172.4	173.6	0	0	0	0	109.1	L368 L375 A383 T384	V358-L368 HydrophobicContact CB-CB 4.42Å; V358-L368 HydrophobicContact CG1-CB 3.81Å; V358-L368 HydrophobicContact CG1-CD1 3.96Å; V358-L368 HydrophobicContact CG1-CG 4.45Å; V358-L368 HydrophobicContact CG2-CB 3.75Å; V358-L368 HydrophobicContact CG2-CD1 3.94Å; V358-L375 HydrophobicContact CG2-CB 4.37Å; V358-L375 HydrophobicContact CG2-CD1 3.83Å; V358-A383 HydrophobicContact CG2-CB 3.94Å; V358-T384 HydrophobicContact CB-CG2 3.71Å; V358-T384 HydrophobicContact CG1-CG2 3.67Å; V358-T384 HydrophobicContact CG2-CG2 3.85Å
359	S	83.3	Confident	84.8	Confident	37 Å²	37	48.6 Å²	48.6	26%	0.259	26%	0.257	S	S	.	.			trans	-114.4	-18.9	-167.9	64.3	0	0	0	0	113.8	N153 K357 P369	N153-S359 WeakPolarHBondContact CB-OG 3.31Å; K357-S359 PolarHBondContact O-N 2.75Å; S359-P369 PolarHBondContact N-O 3.4Å; S359-P369 PolarHBondContact OG-O 3Å
360	C	82.3	Confident	84.8	Confident	27 Å²	27	46.1 Å²	46.1	18%	0.182	24%	0.24	C	C	.	.			trans	-162.3	168.3	171.8	60	0	0	0	0	109.9	T155	T155-C360 HydrophobicContact CG2-CB 3.88Å
361	V	77.2	Confident	84.8	Confident	87 Å²	87	45.8 Å²	45.8	53%	0.527	24%	0.238	S	C	.	.			trans	-113.4	111.1	176.1	-177.4	0	0	0	0	109.2	R365 L368	V361-R365 HydrophobicContact CG1-CG 4.25Å; V361-L368 HydrophobicContact CG1-CD2 4.25Å
362	P	76.7	Confident	84.9	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.019	24%	0.239	C	C	.	.			trans	-76	161.5	178.2	33.1	-34.7	0	0	0	110.8	Y205 D364 R365 P369	Y205-P362 HydrophobicContact CD1-CB 3.81Å; Y205-P362 HydrophobicContact CD2-CB 4.44Å; Y205-P362 HydrophobicContact CE1-CB 4.21Å; Y205-P362 HydrophobicContact CG-CB 3.92Å; P362-D364 VanDerWaalsContact C-N 3.29Å; P362-D364 PolarHBondContact O-N 2.76Å; P362-R365 PolarHBondContact O-N 2.8Å; P362-P369 VanDerWaalsContact CD-CD 3.46Å; P362-P369 HydrophobicContact CG-CG 4.29Å
363	P	71	Confident	85.1	Confident	121 Å²	121	44.2 Å²	44.2	79%	0.786	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-34.2	-179.5	-26.5	34.9	0	0	0	115
364	D	68.5	Low	85.2	Confident	58 Å²	58	40.4 Å²	40.4	31%	0.31	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	1.2	-172.9	66.5	-20.6	0	0	0	115	P362 N366 N446 T448	P362-D364 VanDerWaalsContact C-N 3.29Å; P362-D364 PolarHBondContact O-N 2.76Å; D364-N366 PolarHBondContact O-N 2.91Å; D364-N366 PolarHBondContact O-OD1 3.16Å; D364-N446 PolarHBondContact OD2-ND2 2.65Å; D364-T448 WeakPolarHBondContact OD2-CG2 3.42Å; D364-T448 PolarHBondContact OD2-OG1 3.18Å
365	R	64.1	Low	85.2	Confident	172 Å²	172	38 Å²	38	65%	0.649	20%	0.199	S	C	*	.			trans	46.4	-7.3	167.1	-64.1	-167.7	-176.5	-153.5	1.3	120.3	V361 P362 T367	V361-R365 HydrophobicContact CG1-CG 4.25Å; P362-R365 PolarHBondContact O-N 2.8Å; R365-T367 PolarHBondContact O-N 3.07Å
366	N	67.8	Low	84.9	Confident	81 Å²	81	38 Å²	38	43%	0.433	20%	0.2	S	C	.	.	S	Bend	trans	-74.3	-30	-172.6	-67.8	-16.3	0	0	0	112.9	D364 T448 M449	D364-N366 PolarHBondContact O-N 2.91Å; D364-N366 PolarHBondContact O-OD1 3.16Å; N366-T448 HydrophobicContact CB-CG2 3.66Å; N366-M449 WeakPolarHBondContact CB-O 3.29Å
367	T	75.5	Confident	84.6	Confident	11 Å²	11	37.8 Å²	37.8	7%	0.067	20%	0.199	C	C	.	.	S	Bend	trans	-137.2	132.7	172.8	51.4	0	0	0	0	109.2	R365 A376 L396 M449	R365-T367 PolarHBondContact O-N 3.07Å; T367-A376 HydrophobicContact CG2-CB 4.35Å; T367-L396 HydrophobicContact CG2-CD1 4.47Å; T367-L396 HydrophobicContact CG2-CD2 4.43Å; T367-M449 HydrophobicContact CG2-CB 3.77Å; T367-M449 HydrophobicContact CG2-CG 4.4Å
368	L	88.3	Confident	84.4	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.2	-176.2	-58.6	-177.4	0	0	0	110.4	V358 V361 G370 L375 P382 A383 T384	V358-L368 HydrophobicContact CB-CB 4.42Å; V358-L368 HydrophobicContact CG1-CB 3.81Å; V358-L368 HydrophobicContact CG1-CD1 3.96Å; V358-L368 HydrophobicContact CG1-CG 4.45Å; V358-L368 HydrophobicContact CG2-CB 3.75Å; V358-L368 HydrophobicContact CG2-CD1 3.94Å; V361-L368 HydrophobicContact CG1-CD2 4.25Å; L368-G370 PolarHBondContact O-N 3.46Å; L368-L375 PolarHBondContact N-O 2.74Å; L368-L375 PolarHBondContact O-N 3.26Å; L368-P382 HydrophobicContact CD1-CB 3.99Å; L368-A383 HydrophobicContact CD1-CB 4.28Å; L368-T384 HydrophobicContact CD1-CG2 3.82Å
369	P	91.5	Very high	84	Confident	1 Å²	1	31 Å²	31	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	122.5	178.6	-21.6	32.6	0	0	0	112.3	Y205 S359 P362 F374	Y205-P369 HydrophobicContact CD2-CG 3.73Å; Y205-P369 HydrophobicContact CE2-CB 4Å; Y205-P369 HydrophobicContact CE2-CG 3.27Å; S359-P369 PolarHBondContact N-O 3.4Å; S359-P369 PolarHBondContact OG-O 3Å; P362-P369 VanDerWaalsContact CD-CD 3.46Å; P362-P369 HydrophobicContact CG-CG 4.29Å; P369-F374 HydrophobicContact CG-CE1 4.34Å
370	G	93.7	Very high	83.8	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.01	17%	0.171	C	C	.	.			trans	-83.8	-161.5	152.8	0	0	0	0	0	110.8	K357 L368 G372 W373	K357-G370 WeakPolarHBondContact O-CA 3.45Å; L368-G370 PolarHBondContact O-N 3.46Å; G370-G372 PolarHBondContact O-N 2.86Å; G370-W373 PolarHBondContact N-O 2.71Å
371	L	97	Very high	83.7	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.169	C	C	.	.	S	Bend	trans	-86.7	90.4	175.8	-55.6	-175.5	0	0	0	110	S109 L123 R149 L152 N153 L355 W373	S109-L371 VanDerWaalsContact CB-O 3.23Å; S109-L371 WeakPolarHBondContact CB-O 3.43Å; S109-L371 PolarHBondContact OG-O 3Å; L123-L371 HydrophobicContact CD1-CD1 3.78Å; L123-L371 HydrophobicContact CD2-CD1 4.06Å; R149-L371 HydrophobicContact CG-CD2 3.97Å; L152-L371 HydrophobicContact CB-CB 3.85Å; L152-L371 HydrophobicContact CB-CD2 4.15Å; L152-L371 HydrophobicContact CD1-CB 3.98Å; L152-L371 HydrophobicContact CD1-CD1 4.49Å; L152-L371 HydrophobicContact CG-CB 4.42Å; N153-L371 HydrophobicContact CB-CD2 4.16Å; L355-L371 HydrophobicContact CD2-CB 4.15Å; L355-L371 HydrophobicContact CD2-CD1 4.35Å; L355-L371 PolarHBondContact O-N 3.46Å; L371-W373 VanDerWaalsContact C-N 3.34Å; L371-W373 VanDerWaalsContact O-CD1 3.31Å
372	G	96.6	Very high	83.8	Confident	3 Å²	3	28.4 Å²	28.4	3%	0.031	16%	0.155	C	C	.	.	S	Bend	trans	77.6	16.4	-176	0	0	0	0	0	114.9	P106 L152 G370	P106-G372 VanDerWaalsContact CD-O 3.26Å; P106-G372 WeakPolarHBondContact CD-O 3.25Å; L152-G372 PolarHBondContact O-N 2.71Å; G370-G372 PolarHBondContact O-N 2.86Å
373	W	96.1	Very high	84	Confident	3 Å²	3	29.5 Å²	29.5	1%	0.011	16%	0.164	C	C	.	.	S	Bend	trans	-135.3	158.5	179	-66.2	91.5	0	0	0	110.4	P106 S109 L332 W356 G370 L371 L410	P106-W373 HydrophobicContact CB-CD2 4.28Å; P106-W373 HydrophobicContact CB-CE3 4.35Å; P106-W373 HydrophobicContact CB-CH2 3.57Å; P106-W373 HydrophobicContact CB-CZ2 3.47Å; P106-W373 VanDerWaalsContact CB-CZ2 3.47Å; P106-W373 HydrophobicContact CB-CZ3 4.02Å; P106-W373 HydrophobicContact CG-CD2 4.08Å; P106-W373 HydrophobicContact CG-CE3 3.97Å; P106-W373 HydrophobicContact CG-CH2 4.03Å; P106-W373 HydrophobicContact CG-CZ2 4.15Å; P106-W373 HydrophobicContact CG-CZ3 3.94Å; S109-W373 PolarHBondContact OG-NE1 3.47Å; L332-W373 HydrophobicContact CD1-CH2 3.27Å; L332-W373 HydrophobicContact CD1-CZ2 3.44Å; L332-W373 VanDerWaalsContact CD1-CZ2 3.44Å; L332-W373 HydrophobicContact CD1-CZ3 4.41Å; W356-W373 AromaticContact CD1-CD1 3.71Å; W356-W373 AromaticContact CD1-CG 3.64Å; W356-W373 AromaticContact NE1-CD1 3.69Å; W356-W373 AromaticContact NE1-CD2 3.33Å; W356-W373 VanDerWaalsContact NE1-CD2 3.33Å; W356-W373 AromaticContact NE1-CE2 3.48Å; W356-W373 AromaticContact NE1-CE3 3.81Å; W356-W373 AromaticContact NE1-CG 3.5Å; W356-W373 AromaticContact NE1-NE1 3.7Å; G370-W373 PolarHBondContact N-O 2.71Å; L371-W373 VanDerWaalsContact C-N 3.34Å; L371-W373 VanDerWaalsContact O-CD1 3.31Å; W373-L410 HydrophobicContact CZ3-CD1 4.1Å
374	F	94	Very high	84.5	Confident	21 Å²	21	27.8 Å²	27.8	9%	0.092	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.5	164.4	-67.8	-63.9	0	0	0	110	Y205 Y207 P369 L396 H397	Y205-F374 WeakPolarHBondContact OH-CE1 3.49Å; Y207-F374 HydrophobicContact CD2-CZ 4.17Å; Y207-F374 HydrophobicContact CE2-CE2 4.26Å; Y207-F374 AromaticContact CE2-CZ 3.82Å; Y207-F374 HydrophobicContact CE2-CZ 3.82Å; P369-F374 HydrophobicContact CG-CE1 4.34Å; F374-L396 HydrophobicContact CB-CD1 3.86Å; F374-L396 HydrophobicContact CB-CG 3.91Å; F374-L396 PolarHBondContact N-O 3.05Å; F374-L396 PolarHBondContact O-N 3.08Å; F374-H397 AromaticContact CD2-CD2 3.99Å; F374-H397 AromaticContact CE2-CE1 3.79Å; F374-H397 AromaticContact CE2-NE2 3.61Å
375	L	93.7	Very high	84.7	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.4	-177.3	-56.9	169	0	0	0	109.7	W356 V358 L368 A383 L393 Y394 A395	W356-L375 VanDerWaalsContact C-CD1 3.45Å; W356-L375 HydrophobicContact CB-CD2 3.96Å; W356-L375 HydrophobicContact CG-CD2 4.1Å; W356-L375 WeakPolarHBondContact O-CD1 3.23Å; V358-L375 HydrophobicContact CG2-CB 4.37Å; V358-L375 HydrophobicContact CG2-CD1 3.83Å; L368-L375 PolarHBondContact N-O 2.74Å; L368-L375 PolarHBondContact O-N 3.26Å; L375-A383 HydrophobicContact CB-CB 3.86Å; L375-L393 HydrophobicContact CD2-CD1 4.46Å; L375-Y394 CarbonylContact C-O 3.58Å; L375-Y394 WeakPolarHBondContact CA-O 3.43Å; L375-A395 HydrophobicContact CD2-CB 4.08Å
376	A	90.4	Very high	85.1	Confident	2 Å²	2	29.5 Å²	29.5	2%	0.017	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	173.1	173.3	0	0	0	0	0	111.2	T367 Y394 L396 I451	T367-A376 HydrophobicContact CG2-CB 4.35Å; A376-Y394 PolarHBondContact N-O 2.85Å; A376-Y394 PolarHBondContact O-N 2.88Å; A376-L396 HydrophobicContact CB-CD2 4.48Å; A376-I451 HydrophobicContact CB-CD1 3.08Å
377	R	87.8	Confident	85	Confident	9 Å²	9	27.5 Å²	27.5	3%	0.034	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	146.9	171.2	-59.2	-57.5	-58.6	168.8	-3.7	110.4	S379 G380 D381 P382 D391 R392 L414	R377-S379 WeakPolarHBondContact CB-OG 3.4Å; R377-S379 PolarHBondContact O-N 3.44Å; R377-G380 PolarHBondContact O-N 3.14Å; R377-D381 HydrophobicContact CB-CB 4.48Å; R377-D381 WeakPolarHBondContact CB-O 3.35Å; R377-D381 HydrophobicContact CG-CB 4.4Å; R377-D381 WeakPolarHBondContact CG-O 3.41Å; R377-D381 PolarHBondContact N-O 2.78Å; R377-P382 WeakPolarHBondContact CG-O 3.32Å; R377-D391 WeakPolarHBondContact CB-OD2 3.49Å; R377-D391 IonicContact CZ-OD2 3.05Å; R377-D391 VanDerWaalsContact CZ-OD2 3.22Å; R377-D391 IonicContact NE-OD2 3.5Å; R377-D391 PolarHBondContact NE-OD2 3.25Å; R377-D391 PolarHBondContact NH2-O 2.53Å; R377-D391 VanDerWaalsContact NH2-O 3.17Å; R377-D391 IonicContact NH2-OD2 3.12Å; R377-D391 PolarHBondContact NH2-OD2 2.94Å; R377-R392 PolarHBondContact NH1-O 3.4Å; R377-L414 VanDerWaalsContact NH2-CG 3.29Å
378	R	86.7	Confident	84.6	Confident	8 Å²	8	31.3 Å²	31.3	3%	0.03	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.2	169	170.1	173	178.3	-82.8	-6.1	111.9	G380 D391 R392 Y394 N455 E495	R378-G380 PolarHBondContact O-N 3.48Å; R378-D391 WeakPolarHBondContact CB-OD1 3.43Å; R378-R392 HydrophobicContact CB-CB 3.86Å; R378-R392 PolarHBondContact N-O 3.26Å; R378-Y394 HydrophobicContact CB-CD1 4.35Å; R378-Y394 HydrophobicContact CB-CE1 3.7Å; R378-Y394 HydrophobicContact CB-CE2 4.03Å; R378-Y394 WeakPolarHBondContact CD-OH 3.29Å; R378-Y394 HydrophobicContact CG-CE1 4.29Å; R378-Y394 HydrophobicContact CG-CE2 4.41Å; R378-Y394 VanDerWaalsContact CG-OH 3.32Å; R378-Y394 WeakPolarHBondContact CG-OH 3.32Å; R378-N455 PolarHBondContact NH1-ND2 3.05Å; R378-N455 VanDerWaalsContact NH1-ND2 3.13Å; R378-N455 PolarHBondContact NH1-OD1 2.83Å; R378-E495 WeakPolarHBondContact CD-OE1 3.29Å; R378-E495 IonicContact CZ-OE1 2.73Å; R378-E495 IonicContact CZ-OE2 2.99Å; R378-E495 IonicContact NE-OE1 3.93Å; R378-E495 PolarHBondContact NE-OE1 3.08Å; R378-E495 IonicContact NE-OE2 3.78Å; R378-E495 PolarHBondContact NE-OE2 3.46Å; R378-E495 IonicContact NH2-OE1 3.75Å; R378-E495 IonicContact NH2-OE2 3.63Å; R378-E495 PolarHBondContact NH2-OE2 2.96Å
379	S	81.7	Confident	83.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.5	175.6	67.2	0	0	0	0	114.8	R377 D381 Y389 D391	R377-S379 WeakPolarHBondContact CB-OG 3.4Å; R377-S379 PolarHBondContact O-N 3.44Å; S379-D381 VanDerWaalsContact C-N 3.29Å; S379-D381 WeakPolarHBondContact CB-OD2 3.34Å; S379-D381 WeakPolarHBondContact OG-CB 3.42Å; S379-D381 PolarHBondContact OG-N 2.7Å; S379-D381 VanDerWaalsContact OG-N 3.14Å; S379-D381 PolarHBondContact OG-OD2 2.85Å; S379-Y389 VanDerWaalsContact CB-OH 3.24Å; S379-Y389 WeakPolarHBondContact CB-OH 3.49Å; S379-Y389 PolarHBondContact OG-OH 2.85Å; S379-D391 PolarHBondContact N-OD1 2.98Å; S379-D391 PolarHBondContact OG-OD2 2.94Å
380	G	80.3	Confident	83.2	Confident	34 Å²	34	35.8 Å²	35.8	35%	0.351	22%	0.218	S	C	.	.	S	Bend	trans	86.4	-3.4	-168	0	0	0	0	0	113.5	R377 R378	R377-G380 PolarHBondContact O-N 3.14Å; R378-G380 PolarHBondContact O-N 3.48Å
381	D	78.4	Confident	82.8	Confident	27 Å²	27	35.8 Å²	35.8	14%	0.144	22%	0.218	C	C	.	.	S	Bend	trans	-73.5	158.2	174.1	-56	-38.3	0	0	0	110.8	R377 S379 N387 Y389	R377-D381 HydrophobicContact CB-CB 4.48Å; R377-D381 WeakPolarHBondContact CB-O 3.35Å; R377-D381 HydrophobicContact CG-CB 4.4Å; R377-D381 WeakPolarHBondContact CG-O 3.41Å; R377-D381 PolarHBondContact N-O 2.78Å; S379-D381 VanDerWaalsContact C-N 3.29Å; S379-D381 WeakPolarHBondContact CB-OD2 3.34Å; S379-D381 WeakPolarHBondContact OG-CB 3.42Å; S379-D381 PolarHBondContact OG-N 2.7Å; S379-D381 VanDerWaalsContact OG-N 3.14Å; S379-D381 PolarHBondContact OG-OD2 2.85Å; D381-N387 WeakPolarHBondContact CB-ND2 3.37Å; D381-N387 PolarHBondContact OD2-ND2 2.96Å; D381-Y389 PolarHBondContact OD2-OH 3.33Å
382	P	80.7	Confident	82.6	Confident	36 Å²	36	35.8 Å²	35.8	23%	0.234	22%	0.218	C	C	.	.			trans	-56.2	140.9	173.8	-23.9	33.7	0	0	0	112.1	L368 R377 T384 E385	L368-P382 HydrophobicContact CD1-CB 3.99Å; R377-P382 WeakPolarHBondContact CG-O 3.32Å; P382-T384 PolarHBondContact O-N 3.05Å; P382-E385 HydrophobicContact CB-CG 4.18Å; P382-E385 HydrophobicContact CG-CG 4.21Å; P382-E385 PolarHBondContact O-N 2.84Å
383	A	81.1	Confident	82.4	Confident	25 Å²	25	36.6 Å²	36.6	21%	0.207	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.8	178.6	0	0	0	0	0	114.6	V358 L368 L375	V358-A383 HydrophobicContact CG2-CB 3.94Å; L368-A383 HydrophobicContact CD1-CB 4.28Å; L375-A383 HydrophobicContact CB-CB 3.86Å
384	T	79.7	Confident	82.3	Confident	85 Å²	85	36.5 Å²	36.5	52%	0.521	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-14.9	175.5	49.5	0	0	0	0	114	V358 L368 P382	V358-T384 HydrophobicContact CB-CG2 3.71Å; V358-T384 HydrophobicContact CG1-CG2 3.67Å; V358-T384 HydrophobicContact CG2-CG2 3.85Å; L368-T384 HydrophobicContact CD1-CG2 3.82Å; P382-T384 PolarHBondContact O-N 3.05Å
385	E	73.3	Confident	82.4	Confident	98 Å²	98	35.5 Å²	35.5	46%	0.458	22%	0.217	S	C	.	.			trans	-82.3	119.9	-177.5	-72.8	-176.4	-174.2	0	0	110.3	P382 N387	P382-E385 HydrophobicContact CB-CG 4.18Å; P382-E385 HydrophobicContact CG-CG 4.21Å; P382-E385 PolarHBondContact O-N 2.84Å; E385-N387 PolarHBondContact O-N 3.45Å; E385-N387 VanDerWaalsContact O-N 3.12Å
386	E	72	Confident	82.5	Confident	169 Å²	169	35.5 Å²	35.5	79%	0.79	22%	0.217	S	C	*	.			trans	-74.4	98.2	165	-75.5	-171.2	175.7	0	0	108.6
387	N	66.7	Low	82.8	Confident	38 Å²	38	35.4 Å²	35.4	20%	0.203	22%	0.216	C	C	.	.			trans	-81.6	126.4	174.6	-68.4	-25.4	0	0	0	108.9	D381 E385 Y389	D381-N387 WeakPolarHBondContact CB-ND2 3.37Å; D381-N387 PolarHBondContact OD2-ND2 2.96Å; E385-N387 PolarHBondContact O-N 3.45Å; E385-N387 VanDerWaalsContact O-N 3.12Å; N387-Y389 HydrophobicContact CB-CD1 3.86Å; N387-Y389 HydrophobicContact CB-CE1 3.61Å; N387-Y389 HydrophobicContact CB-CE2 4.37Å; N387-Y389 HydrophobicContact CB-CG 4.35Å; N387-Y389 PolarHBondContact O-N 3.21Å
388	G	67.9	Low	83.2	Confident	91 Å²	91	35.7 Å²	35.7	94%	0.938	22%	0.219	S	C	*	.	S	Bend	trans	-68.5	27.6	175.2	0	0	0	0	0	114.5
389	Y	72.5	Confident	83.6	Confident	55 Å²	55	35.3 Å²	35.3	22%	0.216	22%	0.217	C	C	.	.	S	Bend	trans	-142.8	151.4	178.7	61.7	-96	0	0	0	111.5	S379 D381 N387 D391	S379-Y389 VanDerWaalsContact CB-OH 3.24Å; S379-Y389 WeakPolarHBondContact CB-OH 3.49Å; S379-Y389 PolarHBondContact OG-OH 2.85Å; D381-Y389 PolarHBondContact OD2-OH 3.33Å; N387-Y389 HydrophobicContact CB-CD1 3.86Å; N387-Y389 HydrophobicContact CB-CE1 3.61Å; N387-Y389 HydrophobicContact CB-CE2 4.37Å; N387-Y389 HydrophobicContact CB-CG 4.35Å; N387-Y389 PolarHBondContact O-N 3.21Å; Y389-D391 HydrophobicContact CD2-CB 4.29Å; Y389-D391 HydrophobicContact CE2-CB 4.21Å; Y389-D391 PolarHBondContact O-N 2.95Å
390	P	77.8	Confident	84.1	Confident	43 Å²	43	37.4 Å²	37.4	28%	0.279	24%	0.239	S	C	.	.			trans	-63.5	134.4	-178.1	-11.9	21.8	0	0	0	111.7	I464 A467	P390-I464 HydrophobicContact CB-CG1 4.45Å; P390-I464 HydrophobicContact CG-CB 4.21Å; P390-I464 HydrophobicContact CG-CG1 3.48Å; P390-I464 VanDerWaalsContact CG-CG1 3.48Å; P390-A467 HydrophobicContact CB-CB 3.34Å
391	D	84.2	Confident	84.5	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.011	23%	0.229	C	C	.	.			trans	-163.4	167.4	-173.2	-178.8	40.7	0	0	0	110.7	R377 R378 S379 Y389 L414 N455	R377-D391 WeakPolarHBondContact CB-OD2 3.49Å; R377-D391 IonicContact CZ-OD2 3.05Å; R377-D391 VanDerWaalsContact CZ-OD2 3.22Å; R377-D391 IonicContact NE-OD2 3.5Å; R377-D391 PolarHBondContact NE-OD2 3.25Å; R377-D391 PolarHBondContact NH2-O 2.53Å; R377-D391 VanDerWaalsContact NH2-O 3.17Å; R377-D391 IonicContact NH2-OD2 3.12Å; R377-D391 PolarHBondContact NH2-OD2 2.94Å; R378-D391 WeakPolarHBondContact CB-OD1 3.43Å; S379-D391 PolarHBondContact N-OD1 2.98Å; S379-D391 PolarHBondContact OG-OD2 2.94Å; Y389-D391 HydrophobicContact CD2-CB 4.29Å; Y389-D391 HydrophobicContact CE2-CB 4.21Å; Y389-D391 PolarHBondContact O-N 2.95Å; D391-L414 WeakPolarHBondContact O-CG 3.43Å; D391-N455 PolarHBondContact OD1-ND2 2.98Å; D391-N455 VanDerWaalsContact OD1-ND2 3.15Å
392	R	92.1	Very high	85.1	Confident	1 Å²	1	35.6 Å²	35.6	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	147.8	-173	-61.7	-179.5	74.3	82.1	-3.2	112.2	R377 R378 Y394 S411 L412 A466 I469 P470	R377-R392 PolarHBondContact NH1-O 3.4Å; R378-R392 HydrophobicContact CB-CB 3.86Å; R378-R392 PolarHBondContact N-O 3.26Å; R392-Y394 HydrophobicContact CB-CE1 4.41Å; R392-S411 PolarHBondContact NE-OG 2.65Å; R392-S411 PolarHBondContact NH2-O 3.46Å; R392-L412 CarbonylContact C-O 3.5Å; R392-L412 VanDerWaalsContact CA-O 3.26Å; R392-L412 WeakPolarHBondContact CA-O 3.4Å; R392-L412 VanDerWaalsContact CB-O 3.23Å; R392-L412 WeakPolarHBondContact CB-O 3.49Å; R392-A466 WeakPolarHBondContact CD-O 3.46Å; R392-A466 PolarHBondContact NH1-O 3.46Å; R392-I469 PolarHBondContact NH1-O 3.29Å; R392-I469 PolarHBondContact NH2-O 3.08Å; R392-P470 PolarHBondContact NH2-O 3.35Å
393	L	92.6	Very high	85.7	Confident	19 Å²	19	33.9 Å²	33.9	10%	0.099	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128	169.8	176.2	66.7	0	0	0	109.6	Y336 W356 L375 L412 L414	Y336-L393 HydrophobicContact CE2-CD2 3.94Å; W356-L393 HydrophobicContact CE3-CD2 4.48Å; L375-L393 HydrophobicContact CD2-CD1 4.46Å; L393-L412 HydrophobicContact CB-CB 4.4Å; L393-L412 HydrophobicContact CD2-CD1 4.45Å; L393-L412 PolarHBondContact N-O 3.36Å; L393-L412 PolarHBondContact O-N 2.99Å; L393-L414 HydrophobicContact CB-CD2 4.47Å
394	Y	94.2	Very high	86.4	Confident	1 Å²	1	32.8 Å²	32.8	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	110	167.1	-72	-4.3	0	0	0	109.3	L375 A376 R378 R392 L409 L410 S411 I451 I491 E495	L375-Y394 CarbonylContact C-O 3.58Å; L375-Y394 WeakPolarHBondContact CA-O 3.43Å; A376-Y394 PolarHBondContact N-O 2.85Å; A376-Y394 PolarHBondContact O-N 2.88Å; R378-Y394 HydrophobicContact CB-CD1 4.35Å; R378-Y394 HydrophobicContact CB-CE1 3.7Å; R378-Y394 HydrophobicContact CB-CE2 4.03Å; R378-Y394 WeakPolarHBondContact CD-OH 3.29Å; R378-Y394 HydrophobicContact CG-CE1 4.29Å; R378-Y394 HydrophobicContact CG-CE2 4.41Å; R378-Y394 VanDerWaalsContact CG-OH 3.32Å; R378-Y394 WeakPolarHBondContact CG-OH 3.32Å; R392-Y394 HydrophobicContact CB-CE1 4.41Å; Y394-L409 HydrophobicContact CD1-CD1 4.22Å; Y394-L409 HydrophobicContact CD2-CD1 4.09Å; Y394-L409 HydrophobicContact CG-CD1 3.81Å; Y394-L410 WeakPolarHBondContact CA-O 3.36Å; Y394-S411 VanDerWaalsContact CE1-OG 3.3Å; Y394-S411 WeakPolarHBondContact CE1-OG 3.46Å; Y394-I451 HydrophobicContact CD2-CD1 4.22Å; Y394-I491 HydrophobicContact CE2-CG1 4.2Å; Y394-I491 HydrophobicContact CE2-CG2 4.46Å; Y394-E495 PolarHBondContact OH-OE1 3.35Å
395	A	95.9	Very high	87.2	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.5	165.6	0	0	0	0	0	108.4	W356 L375 L410	W356-A395 HydrophobicContact CD2-CB 4.04Å; W356-A395 HydrophobicContact CE3-CB 4.34Å; W356-A395 HydrophobicContact CH2-CB 4.18Å; W356-A395 HydrophobicContact CZ2-CB 3.84Å; W356-A395 HydrophobicContact CZ3-CB 4.4Å; L375-A395 HydrophobicContact CD2-CB 4.08Å; A395-L410 HydrophobicContact CB-CB 4.32Å; A395-L410 PolarHBondContact N-O 2.82Å; A395-L410 WeakPolarHBondContact O-CB 2.99Å; A395-L410 VanDerWaalsContact O-CD1 3.28Å; A395-L410 WeakPolarHBondContact O-CD1 3.25Å; A395-L410 PolarHBondContact O-N 3.23Å
396	L	96.3	Very high	88.4	Confident	2 Å²	2	24 Å²	24	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	165	-167.3	67	109.4	0	0	0	113	T367 F374 A376 L408 L409 M449	T367-L396 HydrophobicContact CG2-CD1 4.47Å; T367-L396 HydrophobicContact CG2-CD2 4.43Å; F374-L396 HydrophobicContact CB-CD1 3.86Å; F374-L396 HydrophobicContact CB-CG 3.91Å; F374-L396 PolarHBondContact N-O 3.05Å; F374-L396 PolarHBondContact O-N 3.08Å; A376-L396 HydrophobicContact CB-CD2 4.48Å; L396-L408 CarbonylContact C-O 3.46Å; L396-L408 WeakPolarHBondContact CA-O 3.35Å; L396-L408 VanDerWaalsContact CB-O 3.32Å; L396-L408 WeakPolarHBondContact CB-O 3.47Å; L396-L409 HydrophobicContact CB-CD1 4Å; L396-L409 HydrophobicContact CD2-CD1 4.39Å; L396-M449 HydrophobicContact CB-CE 3.9Å; L396-M449 HydrophobicContact CD1-CE 3.5Å; L396-M449 HydrophobicContact CD1-CG 3.69Å; L396-M449 HydrophobicContact CD1-SD 4.17Å; L396-M449 HydrophobicContact CD2-CE 3.91Å; L396-M449 HydrophobicContact CD2-SD 4.34Å; L396-M449 HydrophobicContact CG-CE 3.92Å
397	H	97.1	Very high	89.7	Confident	1 Å²	1	16 Å²	16	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	137.1	163.2	-155.8	-58.6	0	0	0	110.3	S102 P106 Y207 F374 L408	S102-H397 WeakPolarHBondContact CB-CE1 3.37Å; S102-H397 PolarHBondContact O-CE1 3.38Å; S102-H397 PolarHBondContact O-ND1 3.28Å; P106-H397 HydrophobicContact CG-CB 3.8Å; Y207-H397 PolarHBondContact OH-CE1 3.27Å; Y207-H397 VanDerWaalsContact OH-CE1 3.26Å; F374-H397 AromaticContact CD2-CD2 3.99Å; F374-H397 AromaticContact CE2-CE1 3.79Å; F374-H397 AromaticContact CE2-NE2 3.61Å; H397-L408 PolarHBondContact N-O 2.97Å; H397-L408 PolarHBondContact O-N 3.36Å
398	T	96.1	Very high	91.2	Very high	14 Å²	14	14.2 Å²	14.2	9%	0.086	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	155.2	172	57.5	0	0	0	0	111	S102 T406 V407 N447 S487	S102-T398 WeakPolarHBondContact CB-O 3.41Å; T398-T406 CarbonylContact C-O 3Å; T398-T406 WeakPolarHBondContact CA-O 3.44Å; T398-V407 HydrophobicContact CG2-CB 4.33Å; T398-V407 HydrophobicContact CG2-CG2 3.98Å; T398-N447 HydrophobicContact CG2-CB 4.49Å; T398-N447 PolarHBondContact OG1-O 3.14Å; T398-S487 WeakPolarHBondContact CG2-OG 3.34Å
399	G	94.6	Very high	92.6	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.7	177	0	0	0	0	0	111	T405 T406	G399-T405 CarbonylContact O-C 3.56Å; G399-T405 VanDerWaalsContact O-CA 3.31Å; G399-T405 WeakPolarHBondContact O-CA 3.39Å; G399-T406 VanDerWaalsContact CA-OG1 3.31Å; G399-T406 WeakPolarHBondContact CA-OG1 3.18Å; G399-T406 PolarHBondContact N-O 3.5Å; G399-T406 PolarHBondContact O-N 3.36Å
400	G	93.1	Very high	93.8	Very high	45 Å²	45	7.2 Å²	7.2	46%	0.464	6%	0.055	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.1	165.5	0	0	0	0	0	108.6	A101	A101-G400 VanDerWaalsContact CB-C 3.43Å; A101-G400 WeakPolarHBondContact CB-O 3.33Å
401	A	88.9	Confident	94.7	Very high	17 Å²	17	5.2 Å²	5.2	14%	0.14	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	166.9	172.4	0	0	0	0	0	109.3	R99 A101 G403 G404	R99-A401 HydrophobicContact CB-CB 4.24Å; A101-A401 HydrophobicContact CB-CB 3.51Å; A401-G403 PolarHBondContact O-N 2.75Å; A401-G404 PolarHBondContact N-O 2.86Å; A401-G404 PolarHBondContact O-N 3.15Å; A401-G404 VanDerWaalsContact O-N 3.16Å; A401-G404 VanDerWaalsContact O-O 3.1Å
402	V	91.3	Very high	95.3	Very high	5 Å²	5	5.1 Å²	5.1	3%	0.03	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	117.4	162.2	-179.7	0	0	0	0	107.6	R99 M176 L177 T304 I307 E481	R99-V402 VanDerWaalsContact CD-O 3.27Å; R99-V402 WeakPolarHBondContact CD-O 3.42Å; R99-V402 PolarHBondContact NH1-O 3.3Å; M176-V402 HydrophobicContact CG-CG2 4.2Å; M176-V402 HydrophobicContact SD-CG2 4.29Å; L177-V402 HydrophobicContact CD2-CG1 4.44Å; L177-V402 HydrophobicContact CD2-CG2 3.64Å; T304-V402 HydrophobicContact CG2-CG1 3.97Å; I307-V402 HydrophobicContact CD1-CB 3.63Å; I307-V402 HydrophobicContact CD1-CG1 4.2Å; I307-V402 HydrophobicContact CD1-CG2 3.81Å; I307-V402 HydrophobicContact CG2-CG1 4.39Å; I307-V402 HydrophobicContact CG2-CG2 4.36Å; V402-E481 WeakPolarHBondContact CA-OE1 3.49Å; V402-E481 WeakPolarHBondContact CG1-OE1 3.35Å
403	G	92.8	Very high	95.3	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.01	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	8.3	179.2	0	0	0	0	0	118.2	A401 N479 L480 E481	A401-G403 PolarHBondContact O-N 2.75Å; G403-N479 CarbonylContact O-C 3.56Å; G403-N479 VanDerWaalsContact O-CA 3.3Å; G403-N479 WeakPolarHBondContact O-CA 3.24Å; G403-L480 PolarHBondContact O-N 2.96Å; G403-E481 PolarHBondContact N-OE1 3.26Å
404	G	94.9	Very high	95.1	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.01	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	143	-175.6	0	0	0	0	0	114.8	A401 T478 L480	A401-G404 PolarHBondContact N-O 2.86Å; A401-G404 PolarHBondContact O-N 3.15Å; A401-G404 VanDerWaalsContact O-N 3.16Å; A401-G404 VanDerWaalsContact O-O 3.1Å; G404-T478 WeakPolarHBondContact CA-O 3.46Å; G404-L480 CarbonylContact C-O 3.57Å
405	T	97.8	Very high	94.6	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.9	173.2	-48.8	0	0	0	0	109.1	G399 T478 L480 N482 V483 I486	G399-T405 CarbonylContact O-C 3.56Å; G399-T405 VanDerWaalsContact O-CA 3.31Å; G399-T405 WeakPolarHBondContact O-CA 3.39Å; T405-T478 PolarHBondContact N-O 3.41Å; T405-T478 PolarHBondContact N-OG1 3.14Å; T405-T478 WeakPolarHBondContact O-CB 3.47Å; T405-T478 PolarHBondContact O-N 3.05Å; T405-T478 PolarHBondContact O-OG1 2.9Å; T405-L480 WeakPolarHBondContact CB-O 3.33Å; T405-L480 PolarHBondContact N-O 3.34Å; T405-L480 VanDerWaalsContact N-O 3.08Å; T405-L480 PolarHBondContact OG1-O 3.41Å; T405-N482 PolarHBondContact OG1-N 3.45Å; T405-V483 HydrophobicContact CG2-CB 4.03Å; T405-V483 PolarHBondContact OG1-N 3.1Å; T405-V483 VanDerWaalsContact OG1-N 3.08Å; T405-I486 HydrophobicContact CG2-CD1 4.23Å; T405-I486 HydrophobicContact CG2-CG2 4.07Å; T405-I486 WeakPolarHBondContact O-CD1 3.4Å
406	T	98.4	Very high	93.2	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.3	-170.3	63.3	0	0	0	0	111.8	R99 I100 I103 T398 G399 I476 L477	R99-T406 VanDerWaalsContact O-CG2 3.22Å; R99-T406 WeakPolarHBondContact O-CG2 3.45Å; I100-T406 PolarHBondContact O-OG1 3.12Å; I103-T406 VanDerWaalsContact CD1-OG1 3.23Å; I103-T406 WeakPolarHBondContact CD1-OG1 3.24Å; T398-T406 CarbonylContact C-O 3Å; T398-T406 WeakPolarHBondContact CA-O 3.44Å; G399-T406 VanDerWaalsContact CA-OG1 3.31Å; G399-T406 WeakPolarHBondContact CA-OG1 3.18Å; G399-T406 PolarHBondContact N-O 3.5Å; G399-T406 PolarHBondContact O-N 3.36Å; T406-I476 CarbonylContact C-O 3.56Å; T406-I476 VanDerWaalsContact CA-O 3.26Å; T406-I476 WeakPolarHBondContact CA-O 3.4Å; T406-L477 HydrophobicContact CG2-CB 4.26Å; T406-L477 HydrophobicContact CG2-CD2 3.45Å; T406-L477 VanDerWaalsContact CG2-CD2 3.45Å; T406-L477 HydrophobicContact CG2-CG 4.47Å
407	V	98.1	Very high	91	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	141.3	170.3	60.8	0	0	0	0	110.2	T398 M449 A475 I476 I486 A490	T398-V407 HydrophobicContact CG2-CB 4.33Å; T398-V407 HydrophobicContact CG2-CG2 3.98Å; V407-M449 HydrophobicContact CG2-CE 4.01Å; V407-A475 WeakPolarHBondContact O-CA 3.27Å; V407-I476 HydrophobicContact CG1-CB 3.85Å; V407-I476 HydrophobicContact CG1-CD1 4.23Å; V407-I476 HydrophobicContact CG1-CG1 4.17Å; V407-I476 PolarHBondContact N-O 3.27Å; V407-I476 PolarHBondContact O-N 3.43Å; V407-I486 HydrophobicContact CB-CG2 4.41Å; V407-I486 HydrophobicContact CG1-CD1 4.17Å; V407-I486 HydrophobicContact CG1-CG1 3.84Å; V407-I486 HydrophobicContact CG1-CG2 4.36Å; V407-A490 HydrophobicContact CG1-CB 3.79Å; V407-A490 HydrophobicContact CG2-CB 4.37Å
408	L	98.7	Very high	87.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.8	166.2	-179.6	61	0	0	0	108	I103 L325 L328 A329 L396 H397 L410 V474 A475	I103-L408 HydrophobicContact CD1-CB 4.06Å; I103-L408 HydrophobicContact CG2-CB 4.23Å; I103-L408 HydrophobicContact CG2-CD2 4.18Å; L325-L408 HydrophobicContact CB-CD1 4.03Å; L328-L408 HydrophobicContact CD2-CD2 4.15Å; A329-L408 HydrophobicContact CB-CD1 4.1Å; L396-L408 CarbonylContact C-O 3.46Å; L396-L408 WeakPolarHBondContact CA-O 3.35Å; L396-L408 VanDerWaalsContact CB-O 3.32Å; L396-L408 WeakPolarHBondContact CB-O 3.47Å; H397-L408 PolarHBondContact N-O 2.97Å; H397-L408 PolarHBondContact O-N 3.36Å; L408-L410 HydrophobicContact CD2-CD1 4.43Å; L408-L410 HydrophobicContact CG-CD1 4.15Å; L408-V474 WeakPolarHBondContact CA-O 3.37Å; L408-A475 HydrophobicContact CD1-CB 4.06Å
409	L	98.1	Very high	84.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.6	179.5	172.3	64.9	0	0	0	109.4	Y394 L396 M449 N473 V474 A490 I491	Y394-L409 HydrophobicContact CD1-CD1 4.22Å; Y394-L409 HydrophobicContact CD2-CD1 4.09Å; Y394-L409 HydrophobicContact CG-CD1 3.81Å; L396-L409 HydrophobicContact CB-CD1 4Å; L396-L409 HydrophobicContact CD2-CD1 4.39Å; L409-M449 HydrophobicContact CB-CE 4.41Å; L409-M449 HydrophobicContact CD1-CE 4Å; L409-N473 CarbonylContact O-C 3.58Å; L409-N473 WeakPolarHBondContact O-CA 3.08Å; L409-V474 HydrophobicContact CB-CB 4.46Å; L409-V474 PolarHBondContact N-O 2.81Å; L409-V474 PolarHBondContact O-N 2.97Å; L409-A490 HydrophobicContact CB-CB 4.41Å; L409-A490 HydrophobicContact CD2-CB 4.23Å; L409-I491 HydrophobicContact CD2-CG1 4.06Å
410	L	98	Very high	81.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.2	168.6	-62.3	82.5	0	0	0	108.2	A329 L332 W356 W373 Y394 A395 L408 L412 N473	A329-L410 HydrophobicContact CB-CD1 4.16Å; A329-L410 HydrophobicContact CB-CD2 4.01Å; A329-L410 HydrophobicContact CB-CG 3.83Å; A329-L410 WeakPolarHBondContact O-CD2 3.23Å; L332-L410 HydrophobicContact CB-CD2 4.17Å; W356-L410 HydrophobicContact CH2-CD2 3.82Å; W356-L410 HydrophobicContact CZ2-CD2 4.03Å; W373-L410 HydrophobicContact CZ3-CD1 4.1Å; Y394-L410 WeakPolarHBondContact CA-O 3.36Å; A395-L410 HydrophobicContact CB-CB 4.32Å; A395-L410 PolarHBondContact N-O 2.82Å; A395-L410 WeakPolarHBondContact O-CB 2.99Å; A395-L410 VanDerWaalsContact O-CD1 3.28Å; A395-L410 WeakPolarHBondContact O-CD1 3.25Å; A395-L410 PolarHBondContact O-N 3.23Å; L408-L410 HydrophobicContact CD2-CD1 4.43Å; L408-L410 HydrophobicContact CG-CD1 4.15Å; L410-L412 HydrophobicContact CB-CD1 4.34Å; L410-L412 HydrophobicContact CB-CD2 4.3Å; L410-L412 HydrophobicContact CB-CG 4.16Å; L410-N473 VanDerWaalsContact CA-OD1 3.29Å; L410-N473 WeakPolarHBondContact CA-OD1 3.18Å; L410-N473 WeakPolarHBondContact CB-OD1 3.5Å; L410-N473 WeakPolarHBondContact CG-OD1 3.36Å
411	S	96.6	Very high	78.3	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	107.4	175.3	173.9	0	0	0	0	108.6	R392 Y394 P471 I472 S494	R392-S411 PolarHBondContact NE-OG 2.65Å; R392-S411 PolarHBondContact NH2-O 3.46Å; Y394-S411 VanDerWaalsContact CE1-OG 3.3Å; Y394-S411 WeakPolarHBondContact CE1-OG 3.46Å; S411-P471 WeakPolarHBondContact O-CA 3.2Å; S411-I472 WeakPolarHBondContact CA-O 3.47Å; S411-I472 VanDerWaalsContact CB-O 3.26Å; S411-I472 WeakPolarHBondContact CB-O 3.31Å; S411-I472 PolarHBondContact N-O 3.04Å; S411-I472 PolarHBondContact O-N 3.49Å; S411-S494 VanDerWaalsContact CB-OG 3.24Å; S411-S494 WeakPolarHBondContact CB-OG 3.2Å; S411-S494 PolarHBondContact OG-OG 2.95Å
412	L	95.2	Very high	75.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.8	-167.9	-56	172.5	0	0	0	111.5	A333 Y336 W356 R392 L393 L410 P471	A333-L412 HydrophobicContact CB-CD2 3.65Å; Y336-L412 HydrophobicContact CD1-CB 4.31Å; Y336-L412 HydrophobicContact CD1-CD1 4.03Å; Y336-L412 HydrophobicContact CD2-CD1 4.37Å; Y336-L412 HydrophobicContact CE1-CB 3.94Å; Y336-L412 HydrophobicContact CE1-CD1 4.27Å; Y336-L412 HydrophobicContact CG-CD1 4.09Å; W356-L412 HydrophobicContact CE3-CD1 4.21Å; W356-L412 HydrophobicContact CH2-CD1 3.7Å; W356-L412 HydrophobicContact CZ3-CD1 3.31Å; R392-L412 CarbonylContact C-O 3.5Å; R392-L412 VanDerWaalsContact CA-O 3.26Å; R392-L412 WeakPolarHBondContact CA-O 3.4Å; R392-L412 VanDerWaalsContact CB-O 3.23Å; R392-L412 WeakPolarHBondContact CB-O 3.49Å; L393-L412 HydrophobicContact CB-CB 4.4Å; L393-L412 HydrophobicContact CD2-CD1 4.45Å; L393-L412 PolarHBondContact N-O 3.36Å; L393-L412 PolarHBondContact O-N 2.99Å; L410-L412 HydrophobicContact CB-CD1 4.34Å; L410-L412 HydrophobicContact CB-CD2 4.3Å; L410-L412 HydrophobicContact CB-CG 4.16Å; L412-P471 HydrophobicContact CD2-CB 3.72Å; L412-P471 HydrophobicContact CD2-CG 3.87Å
413	P	92.5	Very high	72.3	Confident	8 Å²	8	60.1 Å²	60.1	5%	0.052	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	148.9	167.5	29.9	-35.7	0	0	0	110	Y336 M337 A467	Y336-P413 WeakPolarHBondContact CE1-O 3.26Å; Y336-P413 PolarHBondContact OH-O 3.16Å; M337-P413 HydrophobicContact CE-CG 3.73Å; M337-P413 HydrophobicContact SD-CG 3.49Å; M337-P413 WeakPolarHBondContact SD-CG 3.43Å; P413-A467 WeakPolarHBondContact CA-O 3.27Å; P413-A467 WeakPolarHBondContact CB-O 3.47Å
414	L	89.6	Confident	69.2	Low	85 Å²	85	68.1 Å²	68.1	45%	0.445	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-71.6	133.1	169	-92.5	-174.8	0	0	0	110.2	R377 D391 L393	R377-L414 VanDerWaalsContact NH2-CG 3.29Å; D391-L414 WeakPolarHBondContact O-CG 3.43Å; L393-L414 HydrophobicContact CB-CD2 4.47Å
415	L	83.7	Confident	66.2	Low	63 Å²	63	74.8 Å²	74.8	33%	0.33	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-78.9	126.5	165.8	-55.3	173.2	0	0	0	107.8	Y336 M337 N352 N417	Y336-L415 HydrophobicContact CD1-CD1 4.33Å; Y336-L415 HydrophobicContact CD1-CG 4.44Å; Y336-L415 HydrophobicContact CD2-CD1 4.29Å; Y336-L415 HydrophobicContact CE1-CD1 4.01Å; Y336-L415 HydrophobicContact CE1-CD2 4.06Å; Y336-L415 HydrophobicContact CE1-CG 3.73Å; Y336-L415 HydrophobicContact CE2-CD1 3.95Å; Y336-L415 HydrophobicContact CE2-CG 4.26Å; Y336-L415 HydrophobicContact CG-CD1 4.46Å; Y336-L415 VanDerWaalsContact O-CD1 3.25Å; Y336-L415 WeakPolarHBondContact O-CD1 3.41Å; Y336-L415 PolarHBondContact OH-N 3.41Å; M337-L415 HydrophobicContact CE-CD2 4.34Å; M337-L415 HydrophobicContact SD-CD2 4.12Å; N352-L415 WeakPolarHBondContact ND2-CD1 3.3Å; L415-N417 PolarHBondContact O-N 2.97Å
416	C	64.7	Low	62.9	Low	119 Å²	119	82.1 Å²	82.1	80%	0.804	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-58.9	131.2	167.2	-62.9	0	0	0	0	108.3	N418	C416-N418 PolarHBondContact O-N 2.75Å
417	N	51	Low	59.6	Low	124 Å²	124	90.3 Å²	90.3	66%	0.663	49%	0.492	S	S	*	.			trans	-56.3	106.3	173.6	-79	-23.9	0	0	0	108.3	L415 D419	L415-N417 PolarHBondContact O-N 2.97Å; N417-D419 VanDerWaalsContact C-N 3.32Å; N417-D419 PolarHBondContact O-N 2.73Å
418	N	31.3	Very low	56.4	Low	163 Å²	163	98.4 Å²	98.4	87%	0.872	53%	0.534	S	S	*	.			trans	-68.9	101.2	156.5	-86.5	-18.3	0	0	0	105.8	C416 N420	C416-N418 PolarHBondContact O-N 2.75Å; N418-N420 PolarHBondContact O-N 3.13Å
419	D	26.7	Very low	53.1	Low	140 Å²	140	104.9 Å²	104.9	75%	0.749	57%	0.568	S	S	*	*	S	Bend	trans	-41.3	123.2	161.6	-68.1	-47.4	0	0	0	109.4	N417	N417-D419 VanDerWaalsContact C-N 3.32Å; N417-D419 PolarHBondContact O-N 2.73Å
420	N	26.3	Very low	49.7	Very low	155 Å²	155	111.7 Å²	111.7	83%	0.829	61%	0.61	S	S	*	*			trans	143.3	61.1	155.9	-72	-39.4	0	0	0	114.1	N418	N418-N420 PolarHBondContact O-N 3.13Å
421	I	30.1	Very low	46.5	Very low	127 Å²	127	119 Å²	119	65%	0.651	65%	0.647	S	S	*	*			trans	-143.8	120.5	145.2	-52.6	-179.6	0	0	0	108.1	N423	I421-N423 PolarHBondContact O-N 2.54Å
422	P	25.8	Very low	43.1	Very low	118 Å²	118	123.8 Å²	123.8	77%	0.766	69%	0.687	S	S	*	*			trans	-68.7	124	-174.7	27.7	-33.7	0	0	0	111.3	M424	P422-M424 PolarHBondContact O-N 2.59Å; P422-M424 VanDerWaalsContact O-N 3.12Å
423	N	27.8	Very low	40	Very low	158 Å²	158	129.2 Å²	129.2	85%	0.845	73%	0.725	S	S	*	*			trans	-64.1	107.1	164.9	-87.6	-28.4	0	0	0	108.8	I421	I421-N423 PolarHBondContact O-N 2.54Å
424	M	28.1	Very low	36.8	Very low	169 Å²	169	138 Å²	138	83%	0.833	76%	0.762	S	S	*	*			trans	-88.4	140.7	157.7	-86.4	-132.8	-153.6	0	0	109.6	P422	P422-M424 PolarHBondContact O-N 2.59Å; P422-M424 VanDerWaalsContact O-N 3.12Å
425	T	32.3	Very low	33.8	Very low	141 Å²	141	140.4 Å²	140.4	87%	0.865	78%	0.776	S	S	*	*			trans	90.6	100.3	169.7	65.1	0	0	0	0	117.6
426	N	28.4	Very low	31	Very low	154 Å²	154	143.2 Å²	143.2	82%	0.824	79%	0.791	S	S	*	*			trans	-72.6	172	166.8	-74.4	-36.2	0	0	0	112.6
427	E	27.9	Very low	29	Very low	172 Å²	172	144.3 Å²	144.3	80%	0.804	79%	0.789	S	S	*	*			trans	87.7	88.5	159.1	-63.9	-177.9	-169.7	0	0	116.7
428	I	31.1	Very low	27.9	Very low	171 Å²	171	147.1 Å²	147.1	88%	0.877	80%	0.798	S	S	*	*			trans	-111.6	111.3	147.5	-63.7	178.2	0	0	0	107.6	T430	I428-T430 PolarHBondContact O-N 2.84Å
429	N	30.7	Very low	27.5	Very low	135 Å²	135	147 Å²	147	72%	0.722	80%	0.797	S	S	*	*			trans	-60	120.2	169.8	-78.7	-45.1	0	0	0	110.5	I431	N429-I431 PolarHBondContact O-N 3.46Å
430	T	26.3	Very low	27.4	Very low	143 Å²	143	149.7 Å²	149.7	88%	0.877	80%	0.803	S	S	*	*			trans	-68.8	111.7	159.8	36.5	0	0	0	0	109.5	I428	I428-T430 PolarHBondContact O-N 2.84Å
431	I	31.7	Very low	27.3	Very low	153 Å²	153	148.4 Å²	148.4	79%	0.785	79%	0.794	S	S	*	*			trans	-112.9	113.5	160.5	-64	177	0	0	0	107.6	N429	N429-I431 PolarHBondContact O-N 3.46Å
432	A	24.7	Very low	27.1	Very low	101 Å²	101	145.7 Å²	145.7	84%	0.835	79%	0.787	S	S	*	*			trans	-76	123.8	168.1	0	0	0	0	0	109.1
433	S	30.2	Very low	27.1	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	77%	0.765	S	S	*	*			trans	-114.9	110.4	159.5	59.7	0	0	0	0	109.1
434	K	24.1	Very low	27.1	Very low	192 Å²	192	138.3 Å²	138.3	84%	0.835	74%	0.743	S	S	*	*			trans	-71	158.5	155.7	-77.6	179.3	174	178.1	0	108.9
435	D	26.7	Very low	27.1	Very low	136 Å²	136	137.5 Å²	137.5	73%	0.727	74%	0.737	S	S	*	*			trans	101.3	106.2	159.9	-66.7	-9	0	0	0	119.2
436	N	25.5	Very low	27.1	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	72%	0.721	S	S	*	*				88.7	109.8	121.8	-64.3	-25.1	0	0	0	120.4
437	N	23.3	Very low	27.6	Very low	141 Å²	141	130.4 Å²	130.4	75%	0.754	69%	0.694	S	S	*	*			trans	56	82.9	135.5	-69.4	-17.1	0	0	0	117.3
438	H	26.5	Very low	28.1	Very low	183 Å²	183	123.6 Å²	123.6	85%	0.847	66%	0.664	S	S	*	*			trans	-148.5	125.5	141.8	-85.6	-56.4	0	0	0	112.3	F440	H438-F440 PolarHBondContact O-N 3.38Å; H438-F440 VanDerWaalsContact O-N 3.12Å
439	N	23.5	Very low	28.7	Very low	162 Å²	162	115.6 Å²	115.6	87%	0.866	62%	0.623	S	S	*	*			trans	-58.4	103.8	180	-71.9	-40.3	0	0	0	112.2	I441	N439-I441 PolarHBondContact O-N 3.25Å
440	F	25.1	Very low	29.6	Very low	196 Å²	196	115.1 Å²	115.1	86%	0.86	62%	0.619	S	S	*	*			trans	-87.4	100.4	164.3	-94.8	-90.6	0	0	0	109.7	H438	H438-F440 PolarHBondContact O-N 3.38Å; H438-F440 VanDerWaalsContact O-N 3.12Å
441	I	23.4	Very low	30.8	Very low	128 Å²	128	109.3 Å²	109.3	66%	0.656	58%	0.583	S	S	*	*			trans	-107.6	88	163.4	-59.8	178.1	0	0	0	107.4	K163 N439 S443	K163-I441 PolarHBondContact NZ-O 3.05Å; N439-I441 PolarHBondContact O-N 3.25Å; I441-S443 PolarHBondContact O-N 2.82Å
442	S	26.3	Very low	31.8	Very low	70 Å²	70	104.8 Å²	104.8	49%	0.49	57%	0.565	S	S	.	*			trans	-73.5	99.4	161.7	50.9	0	0	0	0	108.5	I444	S442-I444 VanDerWaalsContact C-N 3.27Å
443	S	24.8	Very low	33.2	Very low	44 Å²	44	103.2 Å²	103.2	31%	0.308	55%	0.547	S	S	.	.			trans	-98.1	59.1	162.4	51.1	0	0	0	0	108.8	K163 S171 Y173 I441	K163-S443 WeakPolarHBondContact CE-OG 3.45Å; K163-S443 PolarHBondContact NZ-OG 3.37Å; S171-S443 WeakPolarHBondContact CB-OG 3.38Å; S171-S443 PolarHBondContact OG-OG 3.19Å; S171-S443 VanDerWaalsContact OG-OG 3.12Å; Y173-S443 WeakPolarHBondContact CE2-O 3.47Å; Y173-S443 VanDerWaalsContact OH-C 3.25Å; Y173-S443 PolarHBondContact OH-O 2.8Å; I441-S443 PolarHBondContact O-N 2.82Å
444	I	28.9	Very low	34.3	Very low	76 Å²	76	99.2 Å²	99.2	39%	0.39	52%	0.518	S	S	.	.	S	Bend		-112.1	115.9	125.8	-65.4	167	0	0	0	99.3	Y173 M176 S442 N446	Y173-I444 HydrophobicContact CD2-CG1 4.43Å; Y173-I444 HydrophobicContact CE1-CD1 4.39Å; Y173-I444 HydrophobicContact CE2-CD1 4.16Å; Y173-I444 HydrophobicContact CE2-CG1 3.7Å; M176-I444 HydrophobicContact CE-CD1 3.8Å; S442-I444 VanDerWaalsContact C-N 3.27Å; I444-N446 PolarHBondContact O-N 3.22Å
445	H	28.5	Very low	35.7	Very low	152 Å²	152	90.1 Å²	90.1	70%	0.704	48%	0.479	S	S	*	.			trans	-49	115.7	173.2	-100.4	18.9	0	0	0	106.1	N447	H445-N447 VanDerWaalsContact C-N 3.32Å; H445-N447 PolarHBondContact O-N 3.47Å
446	N	32	Very low	37	Very low	99 Å²	99	90.3 Å²	90.3	53%	0.529	47%	0.473	S	S	.	.			trans	-48.8	108.5	173.8	-121	16	0	0	0	103.7	D364 I444 T448	D364-N446 PolarHBondContact OD2-ND2 2.65Å; I444-N446 PolarHBondContact O-N 3.22Å; N446-T448 WeakPolarHBondContact CB-OG1 3.39Å; N446-T448 PolarHBondContact ND2-OG1 2.96Å; N446-T448 PolarHBondContact O-N 3.1Å
447	N	38.5	Very low	38.6	Very low	47 Å²	47	92.4 Å²	92.4	25%	0.251	48%	0.481	S	S	.	.			trans	-68.9	41.1	163.5	-98.2	-2.9	0	0	0	107.8	T398 H445 M449	T398-N447 HydrophobicContact CG2-CB 4.49Å; T398-N447 PolarHBondContact OG1-O 3.14Å; H445-N447 VanDerWaalsContact C-N 3.32Å; H445-N447 PolarHBondContact O-N 3.47Å; N447-M449 PolarHBondContact O-N 2.74Å; N447-M449 VanDerWaalsContact O-N 3.14Å
448	T	39.4	Very low	40.6	Very low	30 Å²	30	90.1 Å²	90.1	18%	0.184	46%	0.462	C	S	.	.			trans	-62.1	113.3	167.6	-55.5	0	0	0	0	103.8	D364 N366 N446 I450	D364-T448 WeakPolarHBondContact OD2-CG2 3.42Å; D364-T448 PolarHBondContact OD2-OG1 3.18Å; N366-T448 HydrophobicContact CB-CG2 3.66Å; N446-T448 WeakPolarHBondContact CB-OG1 3.39Å; N446-T448 PolarHBondContact ND2-OG1 2.96Å; N446-T448 PolarHBondContact O-N 3.1Å; T448-I450 PolarHBondContact O-N 2.84Å
449	M	43.3	Very low	42.8	Very low	2 Å²	2	85 Å²	85	1%	0.01	45%	0.445	C	S	.	.			trans	-51.3	117.3	164.5	-84.6	-120.3	-164.4	0	0	107.2	N366 T367 L396 V407 L409 N447 I451 I491	N366-M449 WeakPolarHBondContact CB-O 3.29Å; T367-M449 HydrophobicContact CG2-CB 3.77Å; T367-M449 HydrophobicContact CG2-CG 4.4Å; L396-M449 HydrophobicContact CB-CE 3.9Å; L396-M449 HydrophobicContact CD1-CE 3.5Å; L396-M449 HydrophobicContact CD1-CG 3.69Å; L396-M449 HydrophobicContact CD1-SD 4.17Å; L396-M449 HydrophobicContact CD2-CE 3.91Å; L396-M449 HydrophobicContact CD2-SD 4.34Å; L396-M449 HydrophobicContact CG-CE 3.92Å; V407-M449 HydrophobicContact CG2-CE 4.01Å; L409-M449 HydrophobicContact CB-CE 4.41Å; L409-M449 HydrophobicContact CD1-CE 4Å; N447-M449 PolarHBondContact O-N 2.74Å; N447-M449 VanDerWaalsContact O-N 3.14Å; M449-I451 HydrophobicContact CB-CG1 4.24Å; M449-I451 PolarHBondContact O-N 3.03Å; M449-I451 HydrophobicContact SD-CG1 4.3Å; M449-I491 HydrophobicContact SD-CD1 3.76Å; M449-I491 HydrophobicContact SD-CG1 4.21Å
450	I	49.6	Very low	45.3	Very low	126 Å²	126	81.2 Å²	81.2	65%	0.646	43%	0.428	S	S	*	.			trans	-86	100.4	160.3	-59.4	176.4	0	0	0	104.4	T448 S452	T448-I450 PolarHBondContact O-N 2.84Å; I450-S452 PolarHBondContact O-N 3.43Å
451	I	51.8	Low	47.7	Very low	21 Å²	21	76.4 Å²	76.4	11%	0.108	41%	0.411	C	S	.	.			trans	-81.5	100.8	168.4	-61	166.2	0	0	0	105.1	A376 Y394 M449 I491	A376-I451 HydrophobicContact CB-CD1 3.08Å; Y394-I451 HydrophobicContact CD2-CD1 4.22Å; M449-I451 HydrophobicContact CB-CG1 4.24Å; M449-I451 PolarHBondContact O-N 3.03Å; M449-I451 HydrophobicContact SD-CG1 4.3Å; I451-I491 HydrophobicContact CB-CD1 4.47Å; I451-I491 HydrophobicContact CG1-CD1 3.87Å
452	S	51.6	Low	50.3	Low	58 Å²	58	72.2 Å²	72.2	41%	0.406	39%	0.391	S	S	.	.			trans	-64.1	154.4	169.4	55.3	0	0	0	0	109.1	I450 V454	I450-S452 PolarHBondContact O-N 3.43Å; S452-V454 WeakPolarHBondContact O-CG2 3.48Å; S452-V454 PolarHBondContact O-N 2.83Å; S452-V454 WeakPolarHBondContact OG-CG2 3.43Å
453	S	53.8	Low	52.6	Low	67 Å²	67	71.1 Å²	71.1	47%	0.469	38%	0.377	S	S	.	.			trans	-74	52.8	-176.4	57.2	0	0	0	0	113	N455 K456	S453-N455 PolarHBondContact O-N 2.84Å; S453-N455 VanDerWaalsContact O-N 3.1Å; S453-K456 PolarHBondContact O-N 3.23Å
454	V	54.5	Low	55.2	Low	30 Å²	30	72.8 Å²	72.8	18%	0.182	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-54.6	-32.8	-174.6	-175.4	0	0	0	0	111.4	S452 Y458 E495	S452-V454 WeakPolarHBondContact O-CG2 3.48Å; S452-V454 PolarHBondContact O-N 2.83Å; S452-V454 WeakPolarHBondContact OG-CG2 3.43Å; V454-Y458 HydrophobicContact CG1-CE2 4.24Å; V454-E495 HydrophobicContact CG1-CG 4.21Å
455	N	52.6	Low	57.6	Low	2 Å²	2	72.6 Å²	72.6	1%	0.011	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-78	-20.6	-173.8	-153.3	5	0	0	0	114.9	R378 D391 S453 M457 Y458 R463	R378-N455 PolarHBondContact NH1-ND2 3.05Å; R378-N455 VanDerWaalsContact NH1-ND2 3.13Å; R378-N455 PolarHBondContact NH1-OD1 2.83Å; D391-N455 PolarHBondContact OD1-ND2 2.98Å; D391-N455 VanDerWaalsContact OD1-ND2 3.15Å; S453-N455 PolarHBondContact O-N 2.84Å; S453-N455 VanDerWaalsContact O-N 3.1Å; N455-M457 PolarHBondContact O-N 3.32Å; N455-M457 VanDerWaalsContact O-N 3.1Å; N455-Y458 PolarHBondContact O-N 2.86Å; N455-R463 WeakPolarHBondContact OD1-CD 3.3Å; N455-R463 WeakPolarHBondContact OD1-CG 3.14Å
456	K	54.7	Low	60	Low	139 Å²	139	65.4 Å²	65.4	60%	0.604	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-71.1	-5.5	-177.7	-70.2	-175.2	-177.1	174.1	0	113.6	S453	S453-K456 PolarHBondContact O-N 3.23Å
457	M	59.4	Low	62.2	Low	167 Å²	167	61 Å²	61	82%	0.823	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-98.3	-14.5	-177.3	-63.6	-177.2	66.6	0	0	114.4	N455	N455-M457 PolarHBondContact O-N 3.32Å; N455-M457 VanDerWaalsContact O-N 3.1Å
458	Y	63.6	Low	64.5	Low	94 Å²	94	64 Å²	64	37%	0.369	34%	0.338	S	S	.	.	S	Bend	trans	-90.2	142.7	-174.4	-72.1	-83.4	0	0	0	112.9	V454 N455 V462	V454-Y458 HydrophobicContact CG1-CE2 4.24Å; N455-Y458 PolarHBondContact O-N 2.86Å; Y458-V462 HydrophobicContact CD1-CG1 3.82Å; Y458-V462 HydrophobicContact CG-CG1 4.38Å
459	P	73.6	Confident	66.8	Low	74 Å²	74	62.5 Å²	62.5	48%	0.481	33%	0.329	S	S	.	.			trans	-51.8	148.7	167.4	-27.6	37.1	0	0	0	112.8	D461 V462 R463	P459-D461 VanDerWaalsContact C-N 3.31Å; P459-D461 WeakPolarHBondContact CB-OD1 3.48Å; P459-D461 PolarHBondContact O-N 3.11Å; P459-V462 HydrophobicContact CB-CG2 4.21Å; P459-V462 HydrophobicContact CG-CG2 4.4Å; P459-V462 PolarHBondContact O-N 2.64Å; P459-R463 WeakPolarHBondContact O-CG 3.5Å; P459-R463 PolarHBondContact O-N 2.81Å
460	V	75.8	Confident	69.1	Low	84 Å²	84	64.2 Å²	64.2	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-57.7	-42.6	-174.4	176.3	0	0	0	0	112.1	R463 I464	V460-R463 VanDerWaalsContact CG2-NH2 3.28Å; V460-R463 WeakPolarHBondContact O-CB 3.46Å; V460-R463 PolarHBondContact O-N 3.03Å; V460-R463 VanDerWaalsContact O-N 3.15Å; V460-I464 HydrophobicContact CG1-CD1 4.15Å; V460-I464 WeakPolarHBondContact O-CG1 3.33Å; V460-I464 PolarHBondContact O-N 3.46Å
461	D	76.5	Confident	71.3	Confident	94 Å²	94	58.2 Å²	58.2	50%	0.503	31%	0.309	S	S	.	.	H	α-helix	trans	-58.2	-47	176.4	55.7	-54.5	0	0	0	112	P459 R463 I464 K465	P459-D461 VanDerWaalsContact C-N 3.31Å; P459-D461 WeakPolarHBondContact CB-OD1 3.48Å; P459-D461 PolarHBondContact O-N 3.11Å; D461-R463 VanDerWaalsContact C-N 3.28Å; D461-R463 PolarHBondContact O-N 3.06Å; D461-I464 PolarHBondContact O-N 3.36Å; D461-K465 PolarHBondContact O-N 3.04Å; D461-K465 VanDerWaalsContact O-N 3.08Å
462	V	77	Confident	73.5	Confident	40 Å²	40	57.2 Å²	57.2	24%	0.242	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-37.1	175.3	-179.4	0	0	0	0	110.9	Y458 P459 K465 A466 I502	Y458-V462 HydrophobicContact CD1-CG1 3.82Å; Y458-V462 HydrophobicContact CG-CG1 4.38Å; P459-V462 HydrophobicContact CB-CG2 4.21Å; P459-V462 HydrophobicContact CG-CG2 4.4Å; P459-V462 PolarHBondContact O-N 2.64Å; V462-K465 PolarHBondContact O-N 2.81Å; V462-A466 WeakPolarHBondContact O-CB 3.44Å; V462-A466 PolarHBondContact O-N 2.94Å; V462-I502 HydrophobicContact CG1-CD1 4.25Å
463	R	74.4	Confident	75.8	Confident	48 Å²	48	54.4 Å²	54.4	18%	0.181	29%	0.285	C	S	.	.	H	α-helix	trans	-65	-40.1	175.6	-65.6	-170.9	-67.2	171.3	0.6	112.5	N455 P459 V460 D461 A467	N455-R463 WeakPolarHBondContact OD1-CD 3.3Å; N455-R463 WeakPolarHBondContact OD1-CG 3.14Å; P459-R463 WeakPolarHBondContact O-CG 3.5Å; P459-R463 PolarHBondContact O-N 2.81Å; V460-R463 VanDerWaalsContact CG2-NH2 3.28Å; V460-R463 WeakPolarHBondContact O-CB 3.46Å; V460-R463 PolarHBondContact O-N 3.03Å; V460-R463 VanDerWaalsContact O-N 3.15Å; D461-R463 VanDerWaalsContact C-N 3.28Å; D461-R463 PolarHBondContact O-N 3.06Å; R463-A467 WeakPolarHBondContact O-CB 3.43Å; R463-A467 PolarHBondContact O-N 3.16Å
464	I	78.9	Confident	77.9	Confident	78 Å²	78	51.2 Å²	51.2	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-51.6	175.9	-66.7	165.2	0	0	0	110	P390 V460 D461 A466 A467 N468	P390-I464 HydrophobicContact CB-CG1 4.45Å; P390-I464 HydrophobicContact CG-CB 4.21Å; P390-I464 HydrophobicContact CG-CG1 3.48Å; P390-I464 VanDerWaalsContact CG-CG1 3.48Å; V460-I464 HydrophobicContact CG1-CD1 4.15Å; V460-I464 WeakPolarHBondContact O-CG1 3.33Å; V460-I464 PolarHBondContact O-N 3.46Å; D461-I464 PolarHBondContact O-N 3.36Å; I464-A466 PolarHBondContact O-N 3.03Å; I464-A467 PolarHBondContact O-N 2.94Å; I464-N468 PolarHBondContact O-N 3.37Å; I464-N468 PolarHBondContact O-ND2 3.41Å
465	K	80.8	Confident	80	Confident	72 Å²	72	49.8 Å²	49.8	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-58.1	-51.9	178.1	-66.5	-175	-178.7	-172.7	0	111.1	D461 V462 A467 N468 I469 I502 D506	D461-K465 PolarHBondContact O-N 3.04Å; D461-K465 VanDerWaalsContact O-N 3.08Å; V462-K465 PolarHBondContact O-N 2.81Å; K465-A467 PolarHBondContact O-N 3.15Å; K465-A467 VanDerWaalsContact O-N 3.17Å; K465-N468 PolarHBondContact O-N 2.82Å; K465-I469 WeakPolarHBondContact O-CG1 3.42Å; K465-I469 PolarHBondContact O-N 2.73Å; K465-I469 VanDerWaalsContact O-N 3.15Å; K465-I502 HydrophobicContact CB-CG1 4.27Å; K465-I502 HydrophobicContact CB-CG2 4.19Å; K465-I502 HydrophobicContact CD-CG2 4Å; K465-D506 IonicContact NZ-OD1 2.78Å; K465-D506 PolarHBondContact NZ-OD1 3.48Å; K465-D506 IonicContact NZ-OD2 3.78Å
466	A	78.1	Confident	82.2	Confident	2 Å²	2	49.7 Å²	49.7	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-54	-37.7	177.5	0	0	0	0	0	113.7	R392 V462 I464 N468 L498 I502	R392-A466 WeakPolarHBondContact CD-O 3.46Å; R392-A466 PolarHBondContact NH1-O 3.46Å; V462-A466 WeakPolarHBondContact O-CB 3.44Å; V462-A466 PolarHBondContact O-N 2.94Å; I464-A466 PolarHBondContact O-N 3.03Å; A466-N468 VanDerWaalsContact C-N 3.28Å; A466-N468 PolarHBondContact O-N 2.97Å; A466-L498 HydrophobicContact CB-CD1 4.44Å; A466-L498 HydrophobicContact CB-CD2 4Å; A466-L498 HydrophobicContact CB-CG 4.28Å; A466-I502 HydrophobicContact CB-CD1 3.83Å
467	A	79.1	Confident	84.3	Confident	7 Å²	7	43.1 Å²	43.1	6%	0.058	22%	0.224	C	C	.	.	H	α-helix	trans	-70.3	-24.7	179.7	0	0	0	0	0	113.2	P390 P413 R463 I464 K465	P390-A467 HydrophobicContact CB-CB 3.34Å; P413-A467 WeakPolarHBondContact CA-O 3.27Å; P413-A467 WeakPolarHBondContact CB-O 3.47Å; R463-A467 WeakPolarHBondContact O-CB 3.43Å; R463-A467 PolarHBondContact O-N 3.16Å; I464-A467 PolarHBondContact O-N 2.94Å; K465-A467 PolarHBondContact O-N 3.15Å; K465-A467 VanDerWaalsContact O-N 3.17Å
468	N	85.6	Confident	86.1	Confident	108 Å²	108	35.1 Å²	35.1	58%	0.578	19%	0.185	S	C	*	.	H	α-helix	trans	-96.4	-16	-177.5	-66.7	-26.4	0	0	0	113.6	I464 K465 A466	I464-N468 PolarHBondContact O-N 3.37Å; I464-N468 PolarHBondContact O-ND2 3.41Å; K465-N468 PolarHBondContact O-N 2.82Å; A466-N468 VanDerWaalsContact C-N 3.28Å; A466-N468 PolarHBondContact O-N 2.97Å
469	I	87.8	Confident	87.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-51.8	137.3	175.7	-63.5	-53.1	0	0	0	110.3	L71 R392 K465 I472 L498 A501 I502 E505	L71-I469 HydrophobicContact CD1-CG2 4.06Å; R392-I469 PolarHBondContact NH1-O 3.29Å; R392-I469 PolarHBondContact NH2-O 3.08Å; K465-I469 WeakPolarHBondContact O-CG1 3.42Å; K465-I469 PolarHBondContact O-N 2.73Å; K465-I469 VanDerWaalsContact O-N 3.15Å; I469-I472 HydrophobicContact CG2-CD1 4.2Å; I469-L498 HydrophobicContact CB-CD1 3.6Å; I469-L498 HydrophobicContact CG1-CD1 3.66Å; I469-L498 HydrophobicContact CG2-CD1 3.77Å; I469-A501 HydrophobicContact CD1-CB 3.99Å; I469-A501 HydrophobicContact CG1-CB 4.2Å; I469-A501 HydrophobicContact CG2-CB 3.48Å; I469-A501 VanDerWaalsContact CG2-CB 3.48Å; I469-I502 HydrophobicContact CD1-CG1 3.97Å; I469-I502 HydrophobicContact CG1-CG1 3.85Å; I469-E505 HydrophobicContact CD1-CG 4.18Å; I469-E505 WeakPolarHBondContact CD1-OE1 3.4Å; I469-E505 VanDerWaalsContact CD1-OE2 3.31Å; I469-E505 WeakPolarHBondContact CD1-OE2 3.4Å
470	P	91.8	Very high	88.9	Confident	37 Å²	37	27.5 Å²	27.5	24%	0.24	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-52.1	168.9	174.2	-30.2	36.4	0	0	0	114.5	R392 I472	R392-P470 PolarHBondContact NH2-O 3.35Å; P470-I472 PolarHBondContact O-N 2.81Å
471	P	96.3	Very high	89.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-51.6	134.2	177.2	-31.9	38.9	0	0	0	114.2	S72 A333 M337 S411 L412	S72-P471 PolarHBondContact N-O 2.77Å; A333-P471 HydrophobicContact CB-CB 3.62Å; A333-P471 HydrophobicContact CB-CG 3.78Å; M337-P471 HydrophobicContact CG-CG 3.9Å; M337-P471 HydrophobicContact SD-CG 4.38Å; S411-P471 WeakPolarHBondContact O-CA 3.2Å; L412-P471 HydrophobicContact CD2-CB 3.72Å; L412-P471 HydrophobicContact CD2-CG 3.87Å
472	I	97.9	Very high	90.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.4	169.3	-63.6	171	0	0	0	107.7	V69 S70 L71 S411 I469 P470 L498	V69-I472 HydrophobicContact CG1-CG2 4.09Å; S70-I472 VanDerWaalsContact O-CA 3.3Å; S70-I472 WeakPolarHBondContact O-CA 3.4Å; L71-I472 HydrophobicContact CD1-CD1 4.08Å; L71-I472 HydrophobicContact CD1-CG1 3.54Å; S411-I472 WeakPolarHBondContact CA-O 3.47Å; S411-I472 VanDerWaalsContact CB-O 3.26Å; S411-I472 WeakPolarHBondContact CB-O 3.31Å; S411-I472 PolarHBondContact N-O 3.04Å; S411-I472 PolarHBondContact O-N 3.49Å; I469-I472 HydrophobicContact CG2-CD1 4.2Å; P470-I472 PolarHBondContact O-N 2.81Å; I472-L498 HydrophobicContact CD1-CB 3.84Å; I472-L498 HydrophobicContact CD1-CD1 3.93Å
473	N	98.6	Very high	91.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.8	-177.9	-58	-47	0	0	0	110.3	V69 S70 I326 A329 D330 L409 L410	V69-N473 CarbonylContact C-O 3.53Å; V69-N473 VanDerWaalsContact CA-O 3.22Å; V69-N473 WeakPolarHBondContact CA-O 3.07Å; V69-N473 WeakPolarHBondContact CG1-O 3.42Å; S70-N473 PolarHBondContact N-O 3.44Å; S70-N473 PolarHBondContact O-N 2.97Å; S70-N473 WeakPolarHBondContact OG-CB 3.23Å; I326-N473 VanDerWaalsContact CD1-C 3.44Å; I326-N473 HydrophobicContact CD1-CB 3.73Å; I326-N473 VanDerWaalsContact CD1-O 3.28Å; I326-N473 WeakPolarHBondContact CD1-O 3.39Å; A329-N473 HydrophobicContact CB-CB 3.68Å; D330-N473 PolarHBondContact N-ND2 3.45Å; D330-N473 PolarHBondContact OD1-ND2 3.15Å; L409-N473 CarbonylContact O-C 3.58Å; L409-N473 WeakPolarHBondContact O-CA 3.08Å; L410-N473 VanDerWaalsContact CA-OD1 3.29Å; L410-N473 WeakPolarHBondContact CA-OD1 3.18Å; L410-N473 WeakPolarHBondContact CB-OD1 3.5Å; L410-N473 WeakPolarHBondContact CG-OD1 3.36Å
474	V	98.7	Very high	92	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.8	-178.2	-174.7	0	0	0	0	109.9	V69 L408 L409 I476 A490 L493	V69-V474 HydrophobicContact CG1-CG2 4.23Å; V69-V474 HydrophobicContact CG2-CG1 4.14Å; V69-V474 HydrophobicContact CG2-CG2 4.09Å; L408-V474 WeakPolarHBondContact CA-O 3.37Å; L409-V474 HydrophobicContact CB-CB 4.46Å; L409-V474 PolarHBondContact N-O 2.81Å; L409-V474 PolarHBondContact O-N 2.97Å; V474-I476 HydrophobicContact CG1-CD1 4.34Å; V474-I476 HydrophobicContact CG1-CG1 4.07Å; V474-A490 HydrophobicContact CB-CB 4.42Å; V474-A490 HydrophobicContact CG1-CB 3.98Å; V474-L493 HydrophobicContact CG1-CB 4.31Å; V474-L493 HydrophobicContact CG1-CD1 4.21Å; V474-L493 HydrophobicContact CG2-CB 4.47Å
475	A	98.8	Very high	92.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.6	171.8	0	0	0	0	0	110	V67 C68 A322 L325 I326 V407 L408	V67-A475 WeakPolarHBondContact CA-O 3.44Å; C68-A475 PolarHBondContact N-O 2.89Å; C68-A475 PolarHBondContact O-N 3.07Å; A322-A475 HydrophobicContact CB-CB 4.13Å; L325-A475 HydrophobicContact CB-CB 3.89Å; L325-A475 HydrophobicContact CD1-CB 4.4Å; I326-A475 HydrophobicContact CD1-CB 4.08Å; I326-A475 HydrophobicContact CG1-CB 4.03Å; V407-A475 WeakPolarHBondContact O-CA 3.27Å; L408-A475 HydrophobicContact CD1-CB 4.06Å
476	I	98.6	Very high	93.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	124.7	176.4	-51.5	177.1	0	0	0	108.6	M65 S66 V67 T406 V407 V474 I486 L489 A490 L493	M65-I476 HydrophobicContact CG-CG2 3.92Å; M65-I476 HydrophobicContact SD-CG2 3.79Å; S66-I476 CarbonylContact O-C 3.6Å; S66-I476 WeakPolarHBondContact O-CA 3.41Å; V67-I476 HydrophobicContact CG1-CG1 4.21Å; V67-I476 HydrophobicContact CG2-CG1 4.33Å; V67-I476 HydrophobicContact CG2-CG2 4.13Å; T406-I476 CarbonylContact C-O 3.56Å; T406-I476 VanDerWaalsContact CA-O 3.26Å; T406-I476 WeakPolarHBondContact CA-O 3.4Å; V407-I476 HydrophobicContact CG1-CB 3.85Å; V407-I476 HydrophobicContact CG1-CD1 4.23Å; V407-I476 HydrophobicContact CG1-CG1 4.17Å; V407-I476 PolarHBondContact N-O 3.27Å; V407-I476 PolarHBondContact O-N 3.43Å; V474-I476 HydrophobicContact CG1-CD1 4.34Å; V474-I476 HydrophobicContact CG1-CG1 4.07Å; I476-I486 HydrophobicContact CB-CD1 4.23Å; I476-I486 HydrophobicContact CB-CG1 4.16Å; I476-I486 HydrophobicContact CG2-CD1 3.88Å; I476-I486 HydrophobicContact CG2-CG1 3.83Å; I476-L489 HydrophobicContact CD1-CB 4.08Å; I476-L489 HydrophobicContact CD1-CD2 3.75Å; I476-L489 HydrophobicContact CD1-CG 3.69Å; I476-A490 HydrophobicContact CD1-CB 3.86Å; I476-L493 HydrophobicContact CD1-CD1 4.05Å
477	L	98.7	Very high	94.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.2	-179.6	-52.1	-178.4	0	0	0	110.3	M65 S66 F98 I100 S320 T321 A322 L325 T406	M65-L477 CarbonylContact C-O 3.59Å; M65-L477 VanDerWaalsContact CA-O 3.23Å; M65-L477 WeakPolarHBondContact CA-O 3.49Å; S66-L477 PolarHBondContact N-O 3.28Å; S66-L477 PolarHBondContact O-N 3.27Å; F98-L477 HydrophobicContact CB-CB 3.92Å; F98-L477 HydrophobicContact CB-CD1 4.19Å; F98-L477 HydrophobicContact CD1-CB 4.42Å; F98-L477 HydrophobicContact CD2-CB 3.77Å; F98-L477 HydrophobicContact CD2-CD1 4.03Å; F98-L477 HydrophobicContact CE2-CB 4.39Å; F98-L477 HydrophobicContact CG-CB 3.79Å; F98-L477 HydrophobicContact CG-CD1 4.45Å; I100-L477 HydrophobicContact CG2-CD1 4.42Å; I100-L477 HydrophobicContact CG2-CD2 4Å; S320-L477 WeakPolarHBondContact O-CD1 3.39Å; T321-L477 VanDerWaalsContact C-CD1 3.4Å; A322-L477 HydrophobicContact CB-CD1 4.26Å; A322-L477 HydrophobicContact CB-CG 4.34Å; A322-L477 VanDerWaalsContact N-CD1 3.27Å; L325-L477 HydrophobicContact CD1-CD2 3.74Å; T406-L477 HydrophobicContact CG2-CB 4.26Å; T406-L477 HydrophobicContact CG2-CD2 3.45Å; T406-L477 VanDerWaalsContact CG2-CD2 3.45Å; T406-L477 HydrophobicContact CG2-CG 4.47Å
478	T	98.3	Very high	94.8	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.5	176.2	71.2	0	0	0	0	110.7	M65 G404 T405 L480 V483 I486	M65-T478 HydrophobicContact CB-CG2 4.2Å; M65-T478 HydrophobicContact CG-CG2 3.8Å; M65-T478 HydrophobicContact SD-CG2 3.77Å; G404-T478 WeakPolarHBondContact CA-O 3.46Å; T405-T478 PolarHBondContact N-O 3.41Å; T405-T478 PolarHBondContact N-OG1 3.14Å; T405-T478 WeakPolarHBondContact O-CB 3.47Å; T405-T478 PolarHBondContact O-N 3.05Å; T405-T478 PolarHBondContact O-OG1 2.9Å; T478-L480 VanDerWaalsContact C-N 3.33Å; T478-L480 PolarHBondContact OG1-O 2.99Å; T478-V483 HydrophobicContact CG2-CG2 4.49Å; T478-I486 HydrophobicContact CG2-CD1 4.05Å
479	N	97.8	Very high	95.4	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.011	12%	0.119	C	C	.	.	S	Bend	trans	-97.7	31.1	171.4	60.8	-0.7	0	0	0	113.3	P63 G64 Y83 A84 F98 A290 A291 Y293 G403	P63-N479 WeakPolarHBondContact CD-OD1 3.39Å; G64-N479 WeakPolarHBondContact CA-OD1 3.5Å; G64-N479 PolarHBondContact N-OD1 2.91Å; G64-N479 PolarHBondContact O-N 3.33Å; G64-N479 PolarHBondContact O-OD1 3.44Å; Y83-N479 PolarHBondContact O-ND2 2.87Å; A84-N479 PolarHBondContact O-ND2 3.36Å; F98-N479 HydrophobicContact CD1-CB 3.93Å; F98-N479 HydrophobicContact CE1-CB 3.8Å; A290-N479 HydrophobicContact CB-CB 4.2Å; A291-N479 WeakPolarHBondContact O-CB 3.24Å; Y293-N479 WeakPolarHBondContact CB-O 3.19Å; Y293-N479 HydrophobicContact CD2-CB 4.31Å; Y293-N479 WeakPolarHBondContact CD2-O 3.19Å; Y293-N479 PolarHBondContact N-O 3.38Å; G403-N479 CarbonylContact O-C 3.56Å; G403-N479 VanDerWaalsContact O-CA 3.3Å; G403-N479 WeakPolarHBondContact O-CA 3.24Å
480	L	97.2	Very high	95.8	Very high	6 Å²	6	20.3 Å²	20.3	3%	0.031	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-127.1	135.3	178.7	-177.5	62	0	0	0	110.4	Y293 R295 L301 G403 G404 T405 T478 V483	Y293-L480 WeakPolarHBondContact O-CA 3.42Å; R295-L480 HydrophobicContact CB-CD1 4.39Å; L301-L480 HydrophobicContact CD1-CD1 4.05Å; G403-L480 PolarHBondContact O-N 2.96Å; G404-L480 CarbonylContact C-O 3.57Å; T405-L480 WeakPolarHBondContact CB-O 3.33Å; T405-L480 PolarHBondContact N-O 3.34Å; T405-L480 VanDerWaalsContact N-O 3.08Å; T405-L480 PolarHBondContact OG1-O 3.41Å; T478-L480 VanDerWaalsContact C-N 3.33Å; T478-L480 PolarHBondContact OG1-O 2.99Å; L480-V483 HydrophobicContact CB-CG2 3.73Å; L480-V483 HydrophobicContact CD2-CG2 3.95Å; L480-V483 HydrophobicContact CG-CG2 3.89Å; L480-V483 WeakPolarHBondContact O-CG2 3.49Å
481	E	93.4	Very high	96	Very high	46 Å²	46	18.8 Å²	18.8	22%	0.215	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	146.1	170.8	-67.9	-176.3	-174.8	0	0	112.6	Y293 C294 T304 V402 G403 V483	Y293-E481 PolarHBondContact O-N 3.09Å; C294-E481 HydrophobicContact CB-CB 4.39Å; C294-E481 HydrophobicContact CB-CG 4.19Å; C294-E481 WeakPolarHBondContact CB-OE2 3.28Å; T304-E481 HydrophobicContact CG2-CG 4.44Å; T304-E481 WeakPolarHBondContact CG2-OE1 3.48Å; V402-E481 WeakPolarHBondContact CA-OE1 3.49Å; V402-E481 WeakPolarHBondContact CG1-OE1 3.35Å; G403-E481 PolarHBondContact N-OE1 3.26Å; E481-V483 PolarHBondContact O-N 3.25Å
482	N	89.7	Confident	95.9	Very high	113 Å²	113	21.5 Å²	21.5	60%	0.604	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	40.6	167.6	-54.4	-49	0	0	0	114.5	T405 S484	T405-N482 PolarHBondContact OG1-N 3.45Å; N482-S484 PolarHBondContact O-N 2.86Å; N482-S484 VanDerWaalsContact O-N 3.08Å
483	V	94.2	Very high	95.9	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.012	12%	0.123	C	C	.	.			trans	-74.9	97.4	175	-178.4	0	0	0	0	110	F56 M60 T405 T478 L480 E481	F56-V483 HydrophobicContact CE1-CG1 3.66Å; F56-V483 HydrophobicContact CZ-CG1 3.67Å; M60-V483 HydrophobicContact CB-CG1 4.02Å; M60-V483 HydrophobicContact CE-CG1 4.35Å; M60-V483 HydrophobicContact CG-CG1 4.04Å; T405-V483 HydrophobicContact CG2-CB 4.03Å; T405-V483 PolarHBondContact OG1-N 3.1Å; T405-V483 VanDerWaalsContact OG1-N 3.08Å; T478-V483 HydrophobicContact CG2-CG2 4.49Å; L480-V483 HydrophobicContact CB-CG2 3.73Å; L480-V483 HydrophobicContact CD2-CG2 3.95Å; L480-V483 HydrophobicContact CG-CG2 3.89Å; L480-V483 WeakPolarHBondContact O-CG2 3.49Å; E481-V483 PolarHBondContact O-N 3.25Å
484	S	92.4	Very high	95.8	Very high	64 Å²	64	21.5 Å²	21.5	45%	0.448	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	152.8	175.2	61.7	0	0	0	0	112.3	F56 M60 N482 I486	F56-S484 WeakPolarHBondContact CZ-O 3.45Å; M60-S484 WeakPolarHBondContact CE-O 3.37Å; M60-S484 WeakPolarHBondContact CE-OG 3.49Å; N482-S484 PolarHBondContact O-N 2.86Å; N482-S484 VanDerWaalsContact O-N 3.08Å; S484-I486 PolarHBondContact O-N 2.95Å
485	G	93.4	Very high	95.5	Very high	31 Å²	31	22.3 Å²	22.3	32%	0.32	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	2.4	177.9	0	0	0	0	0	115.5	F56 S487 E488 L489	F56-G485 WeakPolarHBondContact CE2-O 3.43Å; G485-S487 PolarHBondContact O-N 3.04Å; G485-E488 WeakPolarHBondContact O-CB 3.21Å; G485-E488 PolarHBondContact O-N 3.21Å; G485-E488 VanDerWaalsContact O-N 3.09Å; G485-L489 PolarHBondContact O-N 2.76Å
486	I	95.4	Very high	95.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.1	-37.2	179.3	-161.9	179.1	0	0	0	112.2	F56 T405 V407 I476 T478 S484 L489 A490	F56-I486 HydrophobicContact CZ-CB 4.17Å; T405-I486 HydrophobicContact CG2-CD1 4.23Å; T405-I486 HydrophobicContact CG2-CG2 4.07Å; T405-I486 WeakPolarHBondContact O-CD1 3.4Å; V407-I486 HydrophobicContact CB-CG2 4.41Å; V407-I486 HydrophobicContact CG1-CD1 4.17Å; V407-I486 HydrophobicContact CG1-CG1 3.84Å; V407-I486 HydrophobicContact CG1-CG2 4.36Å; I476-I486 HydrophobicContact CB-CD1 4.23Å; I476-I486 HydrophobicContact CB-CG1 4.16Å; I476-I486 HydrophobicContact CG2-CD1 3.88Å; I476-I486 HydrophobicContact CG2-CG1 3.83Å; T478-I486 HydrophobicContact CG2-CD1 4.05Å; S484-I486 PolarHBondContact O-N 2.95Å; I486-L489 PolarHBondContact O-N 3.16Å; I486-A490 PolarHBondContact O-N 3.29Å
487	S	93.5	Very high	95.2	Very high	9 Å²	9	22.7 Å²	22.7	6%	0.063	13%	0.129	C	C	.	.	H	α-helix	trans	-66.9	-39	175.9	-58.7	0	0	0	0	112.4	T398 G485 L489 A490 I491	T398-S487 WeakPolarHBondContact CG2-OG 3.34Å; G485-S487 PolarHBondContact O-N 3.04Å; S487-L489 VanDerWaalsContact C-N 3.35Å; S487-A490 WeakPolarHBondContact O-CB 2.88Å; S487-A490 PolarHBondContact O-N 2.92Å; S487-I491 WeakPolarHBondContact O-CG1 3.35Å; S487-I491 PolarHBondContact O-N 3.42Å
488	E	93.3	Very high	94.9	Very high	107 Å²	107	22.8 Å²	22.8	50%	0.5	13%	0.129	S	C	.	.	H	α-helix	trans	-65.1	-41.1	176	-170	-171.7	166.2	0	0	110.5	G485 A490 I491 N492	G485-E488 WeakPolarHBondContact O-CB 3.21Å; G485-E488 PolarHBondContact O-N 3.21Å; G485-E488 VanDerWaalsContact O-N 3.09Å; E488-A490 VanDerWaalsContact C-N 3.32Å; E488-A490 PolarHBondContact O-N 3.23Å; E488-I491 PolarHBondContact O-N 3.1Å; E488-N492 WeakPolarHBondContact O-CB 3.41Å; E488-N492 PolarHBondContact O-N 2.87Å; E488-N492 PolarHBondContact O-ND2 2.96Å
489	L	96.8	Very high	94.6	Very high	10 Å²	10	25.2 Å²	25.2	5%	0.052	14%	0.142	C	C	.	.	H	α-helix	trans	-59.7	-43.1	172	177.8	63.1	0	0	0	111.5	M52 F56 M65 I476 G485 I486 S487 N492 L493	M52-L489 HydrophobicContact CB-CD1 4.11Å; M52-L489 HydrophobicContact CE-CD1 4.29Å; F56-L489 HydrophobicContact CB-CD1 4.39Å; F56-L489 HydrophobicContact CB-CD2 3.83Å; F56-L489 HydrophobicContact CD1-CD2 3.55Å; F56-L489 HydrophobicContact CD2-CB 4.1Å; F56-L489 HydrophobicContact CD2-CD2 4.12Å; F56-L489 HydrophobicContact CE1-CD2 4.09Å; F56-L489 HydrophobicContact CE2-CB 4.22Å; F56-L489 HydrophobicContact CG-CB 4.41Å; F56-L489 HydrophobicContact CG-CD2 3.56Å; F56-L489 HydrophobicContact CG-CG 4.41Å; M65-L489 HydrophobicContact CE-CD2 4.18Å; I476-L489 HydrophobicContact CD1-CB 4.08Å; I476-L489 HydrophobicContact CD1-CD2 3.75Å; I476-L489 HydrophobicContact CD1-CG 3.69Å; G485-L489 PolarHBondContact O-N 2.76Å; I486-L489 PolarHBondContact O-N 3.16Å; S487-L489 VanDerWaalsContact C-N 3.35Å; L489-N492 PolarHBondContact O-N 3.02Å; L489-L493 HydrophobicContact CD1-CD1 4.24Å; L489-L493 HydrophobicContact CD1-CG 4.2Å; L489-L493 HydrophobicContact CG-CD1 4.11Å; L489-L493 WeakPolarHBondContact O-CB 3.31Å; L489-L493 WeakPolarHBondContact O-CG 3.34Å; L489-L493 PolarHBondContact O-N 3.12Å
490	A	97.5	Very high	94.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-43.4	178	0	0	0	0	0	112.4	V407 L409 V474 I476 I486 S487 E488 L493 S494	V407-A490 HydrophobicContact CG1-CB 3.79Å; V407-A490 HydrophobicContact CG2-CB 4.37Å; L409-A490 HydrophobicContact CB-CB 4.41Å; L409-A490 HydrophobicContact CD2-CB 4.23Å; V474-A490 HydrophobicContact CB-CB 4.42Å; V474-A490 HydrophobicContact CG1-CB 3.98Å; I476-A490 HydrophobicContact CD1-CB 3.86Å; I486-A490 PolarHBondContact O-N 3.29Å; S487-A490 WeakPolarHBondContact O-CB 2.88Å; S487-A490 PolarHBondContact O-N 2.92Å; E488-A490 VanDerWaalsContact C-N 3.32Å; E488-A490 PolarHBondContact O-N 3.23Å; A490-L493 PolarHBondContact O-N 2.98Å; A490-S494 PolarHBondContact O-N 2.82Å
491	I	94.7	Very high	94.1	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-60.8	-51.1	174.1	-67.4	166.9	0	0	0	109.8	Y394 L409 M449 I451 S487 E488 L493 S494 E495	Y394-I491 HydrophobicContact CE2-CG1 4.2Å; Y394-I491 HydrophobicContact CE2-CG2 4.46Å; L409-I491 HydrophobicContact CD2-CG1 4.06Å; M449-I491 HydrophobicContact SD-CD1 3.76Å; M449-I491 HydrophobicContact SD-CG1 4.21Å; I451-I491 HydrophobicContact CB-CD1 4.47Å; I451-I491 HydrophobicContact CG1-CD1 3.87Å; S487-I491 WeakPolarHBondContact O-CG1 3.35Å; S487-I491 PolarHBondContact O-N 3.42Å; E488-I491 PolarHBondContact O-N 3.1Å; I491-L493 VanDerWaalsContact C-N 3.28Å; I491-L493 PolarHBondContact O-N 3.26Å; I491-S494 CarbonylContact O-C 3.59Å; I491-S494 WeakPolarHBondContact O-CA 3.37Å; I491-S494 WeakPolarHBondContact O-CB 3.41Å; I491-S494 PolarHBondContact O-N 3.49Å; I491-E495 HydrophobicContact CG2-CG 4.17Å; I491-E495 WeakPolarHBondContact O-CG 3.36Å; I491-E495 PolarHBondContact O-N 3.34Å
492	N	95.5	Very high	93.9	Very high	58 Å²	58	24.1 Å²	24.1	31%	0.31	14%	0.138	S	C	.	.	H	α-helix	trans	-61.2	-36.1	-177.6	-67.7	-26.9	0	0	0	112.5	M52 E488 L489 E495 L496	M52-N492 HydrophobicContact CE-CB 3.33Å; E488-N492 WeakPolarHBondContact O-CB 3.41Å; E488-N492 PolarHBondContact O-N 2.87Å; E488-N492 PolarHBondContact O-ND2 2.96Å; L489-N492 PolarHBondContact O-N 3.02Å; N492-E495 PolarHBondContact O-N 3.22Å; N492-L496 WeakPolarHBondContact O-CB 3.36Å; N492-L496 PolarHBondContact O-N 2.9Å
493	L	97.4	Very high	93.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.4	-42.6	172.3	-73.4	171	0	0	0	111.5	A49 M52 V53 V67 V69 V474 I476 L489 A490 I491 E495 L496 F497	A49-L493 HydrophobicContact CB-CD2 3.8Å; M52-L493 HydrophobicContact CE-CD2 4.14Å; M52-L493 HydrophobicContact CE-CG 4.25Å; V53-L493 HydrophobicContact CG2-CD1 4.25Å; V53-L493 HydrophobicContact CG2-CD2 4.41Å; V67-L493 HydrophobicContact CG1-CD1 3.67Å; V69-L493 HydrophobicContact CG2-CB 4.45Å; V474-L493 HydrophobicContact CG1-CB 4.31Å; V474-L493 HydrophobicContact CG1-CD1 4.21Å; V474-L493 HydrophobicContact CG2-CB 4.47Å; I476-L493 HydrophobicContact CD1-CD1 4.05Å; L489-L493 HydrophobicContact CD1-CD1 4.24Å; L489-L493 HydrophobicContact CD1-CG 4.2Å; L489-L493 HydrophobicContact CG-CD1 4.11Å; L489-L493 WeakPolarHBondContact O-CB 3.31Å; L489-L493 WeakPolarHBondContact O-CG 3.34Å; L489-L493 PolarHBondContact O-N 3.12Å; A490-L493 PolarHBondContact O-N 2.98Å; I491-L493 VanDerWaalsContact C-N 3.28Å; I491-L493 PolarHBondContact O-N 3.26Å; L493-E495 VanDerWaalsContact C-N 3.32Å; L493-E495 PolarHBondContact O-N 3.45Å; L493-L496 PolarHBondContact O-N 3.19Å; L493-F497 VanDerWaalsContact O-N 3.12Å; L493-F497 PolarHBondContact O-N 3.37Å; L493-F497 VanDerWaalsContact O-CD2 3.23Å; L493-F497 WeakPolarHBondContact O-CD2 3.28Å
494	S	96.1	Very high	93.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-43.2	174.2	-175.3	0	0	0	0	111.6	S411 A490 I491 F497 L498	S411-S494 VanDerWaalsContact CB-OG 3.24Å; S411-S494 WeakPolarHBondContact CB-OG 3.2Å; S411-S494 PolarHBondContact OG-OG 2.95Å; A490-S494 PolarHBondContact O-N 2.82Å; I491-S494 CarbonylContact O-C 3.59Å; I491-S494 WeakPolarHBondContact O-CA 3.37Å; I491-S494 WeakPolarHBondContact O-CB 3.41Å; I491-S494 PolarHBondContact O-N 3.49Å; S494-F497 PolarHBondContact O-N 3.12Å; S494-L498 VanDerWaalsContact O-CB 3.27Å; S494-L498 WeakPolarHBondContact O-CB 3.2Å; S494-L498 PolarHBondContact O-N 2.98Å
495	E	93.5	Very high	92.9	Very high	16 Å²	16	25.3 Å²	25.3	8%	0.075	13%	0.132	C	C	.	.	H	α-helix	trans	-65.8	-41.1	178.3	-66.6	-56.4	145	0	0	112.3	R378 Y394 V454 I491 N492 L493 F497 L498 D499	R378-E495 WeakPolarHBondContact CD-OE1 3.29Å; R378-E495 IonicContact CZ-OE1 2.73Å; R378-E495 IonicContact CZ-OE2 2.99Å; R378-E495 IonicContact NE-OE1 3.93Å; R378-E495 PolarHBondContact NE-OE1 3.08Å; R378-E495 IonicContact NE-OE2 3.78Å; R378-E495 PolarHBondContact NE-OE2 3.46Å; R378-E495 IonicContact NH2-OE1 3.75Å; R378-E495 IonicContact NH2-OE2 3.63Å; R378-E495 PolarHBondContact NH2-OE2 2.96Å; Y394-E495 PolarHBondContact OH-OE1 3.35Å; V454-E495 HydrophobicContact CG1-CG 4.21Å; I491-E495 HydrophobicContact CG2-CG 4.17Å; I491-E495 WeakPolarHBondContact O-CG 3.36Å; I491-E495 PolarHBondContact O-N 3.34Å; N492-E495 PolarHBondContact O-N 3.22Å; L493-E495 VanDerWaalsContact C-N 3.32Å; L493-E495 PolarHBondContact O-N 3.45Å; E495-F497 VanDerWaalsContact C-N 3.32Å; E495-F497 PolarHBondContact O-N 2.9Å; E495-L498 PolarHBondContact O-N 3.28Å; E495-L498 WeakPolarHBondContact O-CB 3.22Å; E495-D499 PolarHBondContact O-N 2.68Å
496	L	95.1	Very high	92.3	Very high	9 Å²	9	26.4 Å²	26.4	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-45	176.8	176.5	65.5	0	0	0	111.4	Y45 R48 A49 M52 N492 L493 Y500	Y45-L496 HydrophobicContact CD1-CD1 3.59Å; Y45-L496 HydrophobicContact CD1-CG 3.97Å; Y45-L496 VanDerWaalsContact CD1-O 3.24Å; Y45-L496 WeakPolarHBondContact CD1-O 3.15Å; Y45-L496 HydrophobicContact CE1-CD1 4.05Å; Y45-L496 VanDerWaalsContact CE1-O 3.27Å; Y45-L496 WeakPolarHBondContact CE1-O 3.42Å; R48-L496 HydrophobicContact CB-CD1 4.01Å; R48-L496 HydrophobicContact CB-CD2 3.99Å; A49-L496 HydrophobicContact CB-CD2 3.7Å; M52-L496 HydrophobicContact SD-CD2 3.93Å; N492-L496 WeakPolarHBondContact O-CB 3.36Å; N492-L496 PolarHBondContact O-N 2.9Å; L493-L496 PolarHBondContact O-N 3.19Å; L496-Y500 PolarHBondContact O-N 3.33Å
497	F	95.3	Very high	91.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-82.3	-16.2	179.7	-70.7	-65	0	0	0	113.6	A49 V69 I76 Y77 L493 S494 E495 Y500 A501	A49-F497 HydrophobicContact CB-CE2 3.97Å; A49-F497 HydrophobicContact CB-CZ 3.85Å; V69-F497 HydrophobicContact CB-CD2 4.16Å; V69-F497 HydrophobicContact CB-CE2 4.16Å; V69-F497 HydrophobicContact CG1-CB 4.48Å; V69-F497 HydrophobicContact CG1-CD2 3.64Å; V69-F497 HydrophobicContact CG1-CE2 4.15Å; V69-F497 HydrophobicContact CG1-CG 4.22Å; V69-F497 HydrophobicContact CG2-CD2 4.17Å; V69-F497 HydrophobicContact CG2-CE2 4.03Å; I76-F497 HydrophobicContact CD1-CB 3.74Å; I76-F497 HydrophobicContact CD1-CD1 3.29Å; I76-F497 HydrophobicContact CD1-CD2 4.24Å; I76-F497 HydrophobicContact CD1-CE1 3.89Å; I76-F497 HydrophobicContact CD1-CG 3.49Å; I76-F497 VanDerWaalsContact CD1-CG 3.49Å; I76-F497 HydrophobicContact CG1-CD1 4.22Å; I76-F497 HydrophobicContact CG1-CE1 4.37Å; I76-F497 HydrophobicContact CG1-CG 4.44Å; Y77-F497 VanDerWaalsContact CB-CZ 3.49Å; Y77-F497 HydrophobicContact CD1-CE2 4.25Å; Y77-F497 HydrophobicContact CD1-CZ 4.46Å; Y77-F497 HydrophobicContact CG-CE2 4.21Å; Y77-F497 AromaticContact CG-CZ 3.98Å; Y77-F497 HydrophobicContact CG-CZ 3.98Å; L493-F497 VanDerWaalsContact O-N 3.12Å; L493-F497 PolarHBondContact O-N 3.37Å; L493-F497 VanDerWaalsContact O-CD2 3.23Å; L493-F497 WeakPolarHBondContact O-CD2 3.28Å; S494-F497 PolarHBondContact O-N 3.12Å; E495-F497 VanDerWaalsContact C-N 3.32Å; E495-F497 PolarHBondContact O-N 2.9Å; F497-Y500 HydrophobicContact CD1-CD1 4.36Å; F497-A501 WeakPolarHBondContact O-CB 3.48Å; F497-A501 PolarHBondContact O-N 2.92Å
498	L	92.8	Very high	90.6	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-69.1	-44.7	166.7	-173.6	63.3	0	0	0	110.7	A466 I469 I472 S494 E495 Y500 A501 I502	A466-L498 HydrophobicContact CB-CD1 4.44Å; A466-L498 HydrophobicContact CB-CD2 4Å; A466-L498 HydrophobicContact CB-CG 4.28Å; I469-L498 HydrophobicContact CB-CD1 3.6Å; I469-L498 HydrophobicContact CG1-CD1 3.66Å; I469-L498 HydrophobicContact CG2-CD1 3.77Å; I472-L498 HydrophobicContact CD1-CB 3.84Å; I472-L498 HydrophobicContact CD1-CD1 3.93Å; S494-L498 VanDerWaalsContact O-CB 3.27Å; S494-L498 WeakPolarHBondContact O-CB 3.2Å; S494-L498 PolarHBondContact O-N 2.98Å; E495-L498 PolarHBondContact O-N 3.28Å; E495-L498 WeakPolarHBondContact O-CB 3.22Å; L498-Y500 VanDerWaalsContact C-N 3.3Å; L498-Y500 PolarHBondContact O-N 2.9Å; L498-A501 PolarHBondContact O-N 2.67Å; L498-I502 PolarHBondContact O-N 3.39Å; L498-I502 HydrophobicContact CG-CD1 4.36Å; L498-I502 WeakPolarHBondContact O-CG1 3.4Å
499	D	91.6	Very high	89.2	Confident	50 Å²	50	37.5 Å²	37.5	27%	0.267	19%	0.193	S	C	.	.	H	α-helix	trans	-59	-41.1	172	176.4	51.1	0	0	0	111.6	Y45 R48 E495 K503	Y45-D499 HydrophobicContact CE1-CB 4.09Å; Y45-D499 WeakPolarHBondContact CE1-OD2 3.35Å; Y45-D499 VanDerWaalsContact OH-CG 3.26Å; Y45-D499 PolarHBondContact OH-OD2 3.37Å; R48-D499 IonicContact NH1-OD2 3.71Å; E495-D499 PolarHBondContact O-N 2.68Å; D499-K503 PolarHBondContact O-N 2.94Å; D499-K503 IonicContact OD2-NZ 2.86Å; D499-K503 WeakPolarHBondContact O-CG 3.47Å
500	Y	92.5	Very high	87.3	Confident	10 Å²	10	47.3 Å²	47.3	4%	0.039	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-48	172.4	171.7	-118.7	0	0	0	112.5	I42 Y45 L71 L496 F497 L498 K503 L504	I42-Y500 HydrophobicContact CB-CE2 3.8Å; I42-Y500 HydrophobicContact CD1-CE1 3.91Å; I42-Y500 HydrophobicContact CG1-CE1 3.97Å; I42-Y500 HydrophobicContact CG1-CE2 3.96Å; Y45-Y500 AromaticContact CD2-CD2 3.56Å; Y45-Y500 HydrophobicContact CD2-CD2 3.56Å; Y45-Y500 HydrophobicContact CD2-CG 4.09Å; Y45-Y500 AromaticContact CE2-CD2 3.86Å; Y45-Y500 HydrophobicContact CE2-CD2 3.86Å; Y45-Y500 HydrophobicContact CE2-CG 4.43Å; Y45-Y500 HydrophobicContact CG-CD2 4.08Å; Y45-Y500 HydrophobicContact CG-CG 4.17Å; L71-Y500 HydrophobicContact CD2-CD1 4.23Å; L71-Y500 HydrophobicContact CD2-CE1 4.27Å; L496-Y500 PolarHBondContact O-N 3.33Å; F497-Y500 HydrophobicContact CD1-CD1 4.36Å; L498-Y500 VanDerWaalsContact C-N 3.3Å; L498-Y500 PolarHBondContact O-N 2.9Å; Y500-K503 PolarHBondContact O-N 2.9Å; Y500-L504 HydrophobicContact CE2-CD2 3.91Å; Y500-L504 PolarHBondContact O-N 3.23Å; Y500-L504 VanDerWaalsContact CZ-CD1 3.43Å; Y500-L504 HydrophobicContact CE2-CG 3.85Å; Y500-L504 HydrophobicContact CE2-CD1 4Å; Y500-L504 HydrophobicContact CE1-CG 4.28Å; Y500-L504 HydrophobicContact CE1-CD1 3.54Å; Y500-L504 HydrophobicContact CD2-CG 4.33Å; Y500-L504 HydrophobicContact CD1-CD1 4.17Å
501	A	91.8	Very high	86.8	Confident	6 Å²	6	49.7 Å²	49.7	5%	0.05	25%	0.25	C	C	.	.	H	α-helix	trans	-65.8	-39.4	-177.4	0	0	0	0	0	112.7	L71 I469 F497 L498 K503 L504 E505	L71-A501 HydrophobicContact CD1-CB 4.07Å; L71-A501 HydrophobicContact CD2-CB 3.94Å; I469-A501 HydrophobicContact CD1-CB 3.99Å; I469-A501 HydrophobicContact CG1-CB 4.2Å; I469-A501 HydrophobicContact CG2-CB 3.48Å; I469-A501 VanDerWaalsContact CG2-CB 3.48Å; F497-A501 WeakPolarHBondContact O-CB 3.48Å; F497-A501 PolarHBondContact O-N 2.92Å; L498-A501 PolarHBondContact O-N 2.67Å; A501-K503 VanDerWaalsContact C-N 3.31Å; A501-K503 PolarHBondContact O-N 3.46Å; A501-L504 WeakPolarHBondContact O-CB 3.44Å; A501-L504 PolarHBondContact O-N 3Å; A501-L504 VanDerWaalsContact O-N 3.17Å; A501-E505 PolarHBondContact O-N 3.3Å; A501-E505 VanDerWaalsContact O-N 3.12Å
502	I	89.2	Confident	86.4	Confident	16 Å²	16	52.1 Å²	52.1	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-43.6	174.8	-66.3	165.6	0	0	0	110.5	V462 K465 A466 I469 L498 L504 E505 D506	V462-I502 HydrophobicContact CG1-CD1 4.25Å; K465-I502 HydrophobicContact CB-CG1 4.27Å; K465-I502 HydrophobicContact CB-CG2 4.19Å; K465-I502 HydrophobicContact CD-CG2 4Å; A466-I502 HydrophobicContact CB-CD1 3.83Å; I469-I502 HydrophobicContact CD1-CG1 3.97Å; I469-I502 HydrophobicContact CG1-CG1 3.85Å; L498-I502 PolarHBondContact O-N 3.39Å; L498-I502 HydrophobicContact CG-CD1 4.36Å; L498-I502 WeakPolarHBondContact O-CG1 3.4Å; I502-L504 VanDerWaalsContact C-N 3.29Å; I502-L504 PolarHBondContact O-N 3.15Å; I502-E505 PolarHBondContact O-N 3.16Å; I502-D506 PolarHBondContact O-N 3.1Å
503	K	87.2	Confident	85.9	Confident	94 Å²	94	51.7 Å²	51.7	41%	0.409	26%	0.259	S	S	.	.	H	α-helix	trans	-67.1	-29	177.2	-71.2	-169.1	-168.6	168.2	0	113.7	Y45 D499 Y500 A501 L507	Y45-K503 WeakPolarHBondContact OH-CD 3.47Å; Y45-K503 WeakPolarHBondContact OH-CE 3.41Å; Y45-K503 PolarHBondContact OH-NZ 2.78Å; D499-K503 PolarHBondContact O-N 2.94Å; D499-K503 IonicContact OD2-NZ 2.86Å; D499-K503 WeakPolarHBondContact O-CG 3.47Å; Y500-K503 PolarHBondContact O-N 2.9Å; A501-K503 VanDerWaalsContact C-N 3.31Å; A501-K503 PolarHBondContact O-N 3.46Å; K503-L507 VanDerWaalsContact O-CG 3.26Å; K503-L507 WeakPolarHBondContact O-CG 3.33Å; K503-L507 PolarHBondContact O-N 2.77Å
504	L	85.6	Confident	85.2	Confident	41 Å²	41	54.8 Å²	54.8	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-45.4	173.4	-73.5	177.2	0	0	0	111.1	Y500 A501 I502 D506 L507 D508	Y500-L504 HydrophobicContact CE2-CD2 3.91Å; Y500-L504 PolarHBondContact O-N 3.23Å; Y500-L504 VanDerWaalsContact CZ-CD1 3.43Å; Y500-L504 HydrophobicContact CE2-CG 3.85Å; Y500-L504 HydrophobicContact CE2-CD1 4Å; Y500-L504 HydrophobicContact CE1-CG 4.28Å; Y500-L504 HydrophobicContact CE1-CD1 3.54Å; Y500-L504 HydrophobicContact CD2-CG 4.33Å; Y500-L504 HydrophobicContact CD1-CD1 4.17Å; A501-L504 WeakPolarHBondContact O-CB 3.44Å; A501-L504 PolarHBondContact O-N 3Å; A501-L504 VanDerWaalsContact O-N 3.17Å; I502-L504 VanDerWaalsContact C-N 3.29Å; I502-L504 PolarHBondContact O-N 3.15Å; L504-D506 PolarHBondContact O-N 2.86Å; L504-D506 VanDerWaalsContact C-N 3.3Å; L504-L507 PolarHBondContact O-N 2.94Å; L504-L507 VanDerWaalsContact O-N 3.12Å; L504-D508 PolarHBondContact O-N 2.86Å
505	E	82.8	Confident	84.5	Confident	68 Å²	68	58.2 Å²	58.2	32%	0.318	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-42	176.5	-71.3	-175.9	170.6	0	0	111.4	I469 A501 I502 L507 D508 D509	I469-E505 HydrophobicContact CD1-CG 4.18Å; I469-E505 WeakPolarHBondContact CD1-OE1 3.4Å; I469-E505 VanDerWaalsContact CD1-OE2 3.31Å; I469-E505 WeakPolarHBondContact CD1-OE2 3.4Å; A501-E505 PolarHBondContact O-N 3.3Å; A501-E505 VanDerWaalsContact O-N 3.12Å; I502-E505 PolarHBondContact O-N 3.16Å; E505-L507 PolarHBondContact O-N 3.38Å; E505-D508 PolarHBondContact O-N 3.05Å; E505-D508 VanDerWaalsContact O-N 3.17Å; E505-D509 PolarHBondContact O-N 2.88Å; E505-D509 VanDerWaalsContact O-N 3.1Å
506	D	81.5	Confident	83.9	Confident	54 Å²	54	61 Å²	61	29%	0.289	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-30.5	176.8	-69.9	-11.2	0	0	0	113.1	K465 I502 L504 E510	K465-D506 IonicContact NZ-OD1 2.78Å; K465-D506 PolarHBondContact NZ-OD1 3.48Å; K465-D506 IonicContact NZ-OD2 3.78Å; I502-D506 PolarHBondContact O-N 3.1Å; L504-D506 PolarHBondContact O-N 2.86Å; L504-D506 VanDerWaalsContact C-N 3.3Å; D506-E510 PolarHBondContact O-N 2.88Å
507	L	77.5	Confident	83.1	Confident	67 Å²	67	64.7 Å²	64.7	35%	0.351	33%	0.325	S	S	.	.	H	α-helix	trans	-82.2	-26.1	177.5	-71.4	169.8	0	0	0	113.1	Y41 K503 L504 E505	Y41-L507 HydrophobicContact CE2-CD1 4.4Å; K503-L507 VanDerWaalsContact O-CG 3.26Å; K503-L507 WeakPolarHBondContact O-CG 3.33Å; K503-L507 PolarHBondContact O-N 2.77Å; L504-L507 PolarHBondContact O-N 2.94Å; L504-L507 VanDerWaalsContact O-N 3.12Å; E505-L507 PolarHBondContact O-N 3.38Å
508	D	74.5	Confident	82.2	Confident	141 Å²	141	69.7 Å²	69.7	75%	0.754	35%	0.35	S	S	*	.	H	α-helix	trans	-78.4	-24.1	175.1	-76	-22.9	0	0	0	111.6	L504 E505	L504-D508 PolarHBondContact O-N 2.86Å; E505-D508 PolarHBondContact O-N 3.05Å; E505-D508 VanDerWaalsContact O-N 3.17Å
509	D	65.3	Low	81.3	Confident	142 Å²	142	75.3 Å²	75.3	76%	0.759	38%	0.378	S	S	*	.			trans	-82.1	-21.1	175.1	-78.8	-19.1	0	0	0	113.7	E505	E505-D509 PolarHBondContact O-N 2.88Å; E505-D509 VanDerWaalsContact O-N 3.1Å
510	E	55.9	Low	80.3	Confident	215 Å²	215	77.6 Å²	77.6	100%	1.005	39%	0.388	S	S	*	.			trans	-82.4	0	175.2	-78.7	-174.2	178.6	0	0	113	D506	D506-E510 PolarHBondContact O-N 2.88Å

Retrieved 510 of 510 residues in 118 ms (Link to these results)

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