G4VKM1_SCHMA Loading...

Large ribosomal subunit protein mL62

AlphaFold DB , UniProt , Accession G4VKM1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 199 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	45.3	Very low	49	Very low	234 Å²	234	174.4 Å²	174.4	100%	1.153	86%	0.859	S	S	*	*				0	109.4	0	-93.4	172.7	150.5	0	0	109.7
2	I	39.7	Very low	49.2	Very low	157 Å²	157	172.3 Å²	172.3	81%	0.805	85%	0.851	S	S	*	*			trans	42.3	113.6	143.6	-42.9	164.1	0	0	0	119.6
3	R	45.9	Very low	48.8	Very low	244 Å²	244	167.2 Å²	167.2	92%	0.921	84%	0.843	S	S	*	*				-175.9	108.5	112.8	-110.2	-177.5	167.7	116.4	-4.8	112.1
4	V	50.8	Low	49.1	Very low	145 Å²	145	171.4 Å²	171.4	88%	0.879	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-92.1	125.9	169	-171.2	0	0	0	0	107.7
5	G	54.2	Low	48.7	Very low	70 Å²	70	167.1 Å²	167.1	72%	0.722	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71.9	126.4	-178.9	0	0	0	0	0	112.2	F7	G5-F7 PolarHBondContact O-N 3.47Å
6	K	52.9	Low	48.6	Very low	203 Å²	203	163.3 Å²	163.3	88%	0.883	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-72.1	118	173.5	-80.9	172.5	170.4	176.4	0	110	L8	K6-L8 PolarHBondContact O-N 3.2Å
7	F	53.5	Low	48.6	Very low	217 Å²	217	162.7 Å²	162.7	95%	0.952	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-70.3	117.2	160.2	-100.6	-97.2	0	0	0	108.7	G5 S9	G5-F7 PolarHBondContact O-N 3.47Å; F7-S9 PolarHBondContact O-N 2.94Å
8	L	47.9	Very low	48.2	Very low	149 Å²	149	165.9 Å²	165.9	78%	0.78	83%	0.826	S	S	*	*			trans	-67.6	112.6	169	-87.6	129.6	0	0	0	108.8	K6 F10	K6-L8 PolarHBondContact O-N 3.2Å; L8-F10 PolarHBondContact O-N 3.12Å
9	S	50.5	Low	48	Very low	103 Å²	103	163.5 Å²	163.5	72%	0.72	83%	0.825	S	S	*	*			trans	-75.5	104.3	166.2	-171.1	0	0	0	0	108.3	F7 Y11	F7-S9 PolarHBondContact O-N 2.94Å; S9-Y11 PolarHBondContact O-N 3.11Å
10	F	48	Very low	48.2	Very low	182 Å²	182	163.5 Å²	163.5	80%	0.798	83%	0.826	S	S	*	*			trans	-72.1	103.8	167.2	-93.3	-92.4	0	0	0	108.5	L8 I12	L8-F10 PolarHBondContact O-N 3.12Å; F10-I12 PolarHBondContact O-N 3.34Å; F10-I12 VanDerWaalsContact O-N 3.1Å
11	Y	50.6	Low	48.7	Very low	214 Å²	214	160.5 Å²	160.5	84%	0.839	82%	0.821	S	S	*	*			trans	-67.6	101.6	162.5	-100.2	-97.1	0	0	0	108.3	S9 S13	S9-Y11 PolarHBondContact O-N 3.11Å; Y11-S13 PolarHBondContact O-N 3.04Å
12	I	50.8	Low	50.1	Low	149 Å²	149	153.6 Å²	153.6	76%	0.764	80%	0.796	S	S	*	*			trans	-71.5	98.7	163.5	-60.1	173.5	0	0	0	106.2	F10 R14	F10-I12 PolarHBondContact O-N 3.34Å; F10-I12 VanDerWaalsContact O-N 3.1Å; I12-R14 PolarHBondContact O-N 3.46Å; I12-R14 VanDerWaalsContact O-N 3.08Å
13	S	44.3	Very low	52.1	Low	106 Å²	106	154.9 Å²	154.9	74%	0.741	80%	0.796	S	S	*	*			trans	-53.7	112.2	167.8	-176.6	0	0	0	0	108.2	Y11	Y11-S13 PolarHBondContact O-N 3.04Å
14	R	53	Low	53.8	Low	227 Å²	227	148 Å²	148	86%	0.857	77%	0.774	S	S	*	*			trans	-58.9	124.9	172.1	-71.2	-174.2	174	-154.2	-1.3	107.1	I12 S16	I12-R14 PolarHBondContact O-N 3.46Å; I12-R14 VanDerWaalsContact O-N 3.08Å; R14-S16 PolarHBondContact O-N 3.44Å
15	P	42.9	Very low	55.6	Low	106 Å²	106	143.3 Å²	143.3	69%	0.688	75%	0.748	S	S	*	*			trans	-59.5	129.1	173.3	26.4	-31.1	0	0	0	107.3	I17	P15-I17 PolarHBondContact O-N 2.95Å
16	S	47.4	Very low	57.3	Low	107 Å²	107	144 Å²	144	75%	0.748	75%	0.747	S	S	*	*			trans	-52.9	107.4	163.7	168.9	0	0	0	0	106.7	R14 R18	R14-S16 PolarHBondContact O-N 3.44Å; S16-R18 PolarHBondContact O-N 3.47Å
17	I	47.8	Very low	59	Low	153 Å²	153	140.9 Å²	140.9	79%	0.785	74%	0.735	S	S	*	*			trans	-68.2	90.7	173.9	-59.3	171.1	0	0	0	105.2	P15 C19	P15-I17 PolarHBondContact O-N 2.95Å; I17-C19 PolarHBondContact O-N 3.01Å
18	R	42.2	Very low	60.6	Low	221 Å²	221	131.8 Å²	131.8	83%	0.834	70%	0.696	S	S	*	*			trans	-56.6	134	165.2	-79.1	-177.8	175.3	-171.2	-1.7	107.5	S16 L20	S16-R18 PolarHBondContact O-N 3.47Å; R18-L20 PolarHBondContact O-N 3.12Å
19	C	44.5	Very low	62.3	Low	120 Å²	120	128.6 Å²	128.6	81%	0.811	69%	0.685	S	S	*	*			trans	-38.5	96.4	176.2	-164.7	0	0	0	0	112.1	I17 S21	I17-C19 PolarHBondContact O-N 3.01Å; C19-S21 VanDerWaalsContact C-N 3.29Å; C19-S21 PolarHBondContact O-N 3.34Å
20	L	51.2	Low	63.9	Low	162 Å²	162	126.4 Å²	126.4	85%	0.848	67%	0.667	S	S	*	*			trans	-80.3	90.7	152.8	-75.4	169.6	0	0	0	104.3	R18 S22	R18-L20 PolarHBondContact O-N 3.12Å; L20-S22 PolarHBondContact O-N 3.37Å
21	S	59.3	Low	65.6	Low	102 Å²	102	121.8 Å²	121.8	71%	0.713	65%	0.65	S	S	*	*			trans	-64	91.8	165	57.9	0	0	0	0	106.8	C19 F23	C19-S21 VanDerWaalsContact C-N 3.29Å; C19-S21 PolarHBondContact O-N 3.34Å; S21-F23 PolarHBondContact O-N 3.2Å
22	S	74.1	Confident	67.5	Low	89 Å²	89	115.4 Å²	115.4	62%	0.622	63%	0.63	S	S	*	*			trans	-59.6	131.8	166.1	55.3	0	0	0	0	107.2	L20 E24	L20-S22 PolarHBondContact O-N 3.37Å; S22-E24 PolarHBondContact O-N 3Å
23	F	82.7	Confident	69.2	Low	183 Å²	183	115.3 Å²	115.3	80%	0.803	62%	0.622	S	S	*	*			trans	-57.4	121.7	178	171.5	-104.3	0	0	0	110.3	S21	S21-F23 PolarHBondContact O-N 3.2Å
24	E	81.8	Confident	71.2	Confident	101 Å²	101	115 Å²	115	47%	0.472	62%	0.617	S	S	.	*			trans	-111.2	114.5	172.3	-57.1	-160.9	144.6	0	0	109.4	S22 N28	S22-E24 PolarHBondContact O-N 3Å; E24-N28 HydrophobicContact CB-CB 4.28Å; E24-N28 WeakPolarHBondContact CB-ND2 3.47Å; E24-N28 WeakPolarHBondContact CG-ND2 3.47Å; E24-N28 PolarHBondContact OE1-ND2 3.2Å
25	S	89.1	Confident	73	Confident	46 Å²	46	112.2 Å²	112.2	32%	0.322	62%	0.619	S	S	.	*			trans	-80.2	167.8	172.6	73.1	0	0	0	0	111.4	Q27 N28 N31	S25-Q27 PolarHBondContact O-N 2.85Å; S25-Q27 VanDerWaalsContact O-N 3.11Å; S25-Q27 PolarHBondContact OG-N 3.05Å; S25-N28 WeakPolarHBondContact O-CB 3.07Å; S25-N28 PolarHBondContact O-N 2.95Å; S25-N28 PolarHBondContact OG-N 3.23Å; S25-N31 PolarHBondContact O-ND2 3.4Å
26	A	88.9	Confident	75	Confident	85 Å²	85	110.3 Å²	110.3	70%	0.702	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-21.6	169.4	0	0	0	0	0	113
27	Q	89.4	Confident	76.6	Confident	136 Å²	136	108.6 Å²	108.6	64%	0.636	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	14.1	177.5	-58	-62.9	-24.5	0	0	112.8	S25 L32	S25-Q27 PolarHBondContact O-N 2.85Å; S25-Q27 VanDerWaalsContact O-N 3.11Å; S25-Q27 PolarHBondContact OG-N 3.05Å; Q27-L32 WeakPolarHBondContact O-CD1 3.44Å
28	N	85.5	Confident	78	Confident	26 Å²	26	104.4 Å²	104.4	14%	0.139	58%	0.575	C	S	.	*			trans	-63.7	135.3	174.6	-177.1	-40.7	0	0	0	109.6	E24 S25 V30 N31 L32	E24-N28 HydrophobicContact CB-CB 4.28Å; E24-N28 WeakPolarHBondContact CB-ND2 3.47Å; E24-N28 WeakPolarHBondContact CG-ND2 3.47Å; E24-N28 PolarHBondContact OE1-ND2 3.2Å; S25-N28 WeakPolarHBondContact O-CB 3.07Å; S25-N28 PolarHBondContact O-N 2.95Å; S25-N28 PolarHBondContact OG-N 3.23Å; N28-V30 PolarHBondContact O-N 2.96Å; N28-V30 VanDerWaalsContact O-N 3.12Å; N28-V30 WeakPolarHBondContact OD1-CG2 3.29Å; N28-V30 PolarHBondContact OD1-N 3.07Å; N28-N31 WeakPolarHBondContact O-CA 3.21Å; N28-N31 WeakPolarHBondContact O-CB 3.34Å; N28-N31 PolarHBondContact O-N 2.95Å; N28-L32 PolarHBondContact O-N 2.87Å
29	P	83.8	Confident	79.8	Confident	83 Å²	83	98.2 Å²	98.2	54%	0.539	56%	0.558	S	S	.	*	H	α-helix	trans	-52.7	-32.8	178.1	20.6	-34.4	0	0	0	114.2	N31 L32 Y33	P29-N31 VanDerWaalsContact C-N 3.29Å; P29-N31 PolarHBondContact O-N 3.45Å; P29-L32 PolarHBondContact O-N 3.48Å; P29-Y33 WeakPolarHBondContact O-CB 3.48Å; P29-Y33 WeakPolarHBondContact O-CD2 3.33Å; P29-Y33 PolarHBondContact O-N 3.13Å
30	V	83.7	Confident	81.5	Confident	57 Å²	57	95 Å²	95	35%	0.345	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-37.5	175.6	-176.7	0	0	0	0	111.4	N28 Y33 P34	N28-V30 PolarHBondContact O-N 2.96Å; N28-V30 VanDerWaalsContact O-N 3.12Å; N28-V30 WeakPolarHBondContact OD1-CG2 3.29Å; N28-V30 PolarHBondContact OD1-N 3.07Å; V30-Y33 CarbonylContact O-C 3.57Å; V30-P34 WeakPolarHBondContact O-CA 3.41Å
31	N	85.3	Confident	82.7	Confident	84 Å²	84	93.5 Å²	93.5	45%	0.449	54%	0.538	S	S	.	.	H	α-helix	trans	-77.4	-37.7	177.4	-67.2	-27.2	0	0	0	112.1	S25 N28 P29 Y33	S25-N31 PolarHBondContact O-ND2 3.4Å; N28-N31 WeakPolarHBondContact O-CA 3.21Å; N28-N31 WeakPolarHBondContact O-CB 3.34Å; N28-N31 PolarHBondContact O-N 2.95Å; P29-N31 VanDerWaalsContact C-N 3.29Å; P29-N31 PolarHBondContact O-N 3.45Å; N31-Y33 VanDerWaalsContact C-N 3.34Å
32	L	88.9	Confident	83.8	Confident	80 Å²	80	96.7 Å²	96.7	42%	0.419	54%	0.539	S	S	.	.	H	α-helix	trans	-70.7	-31	178.2	-64.5	177.9	0	0	0	112.4	Q27 N28 P29	Q27-L32 WeakPolarHBondContact O-CD1 3.44Å; N28-L32 PolarHBondContact O-N 2.87Å; P29-L32 PolarHBondContact O-N 3.48Å
33	Y	88.4	Confident	84.2	Confident	148 Å²	148	98.6 Å²	98.6	58%	0.58	54%	0.536	S	S	*	.			trans	-133.2	69.7	-174.5	-54.1	-73.5	0	0	0	111.5	P29 V30 N31 N35 S36	P29-Y33 WeakPolarHBondContact O-CB 3.48Å; P29-Y33 WeakPolarHBondContact O-CD2 3.33Å; P29-Y33 PolarHBondContact O-N 3.13Å; V30-Y33 CarbonylContact O-C 3.57Å; N31-Y33 VanDerWaalsContact C-N 3.34Å; Y33-N35 PolarHBondContact O-N 2.95Å; Y33-N35 VanDerWaalsContact O-N 3.15Å; Y33-S36 WeakPolarHBondContact CB-OG 3.39Å; Y33-S36 WeakPolarHBondContact O-CB 3.37Å; Y33-S36 PolarHBondContact O-N 2.93Å; Y33-S36 PolarHBondContact O-OG 3.43Å
34	P	85.8	Confident	84.1	Confident	99 Å²	99	98.9 Å²	98.9	64%	0.643	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.6	-171.7	25.7	-35.6	0	0	0	114.1	V30 S36	V30-P34 WeakPolarHBondContact O-CA 3.41Å; P34-S36 VanDerWaalsContact C-N 3.33Å
35	N	89.8	Confident	83.9	Confident	169 Å²	169	100.1 Å²	100.1	90%	0.904	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-2	177.8	-63.2	-27.3	0	0	0	113.1	Y33	Y33-N35 PolarHBondContact O-N 2.95Å; Y33-N35 VanDerWaalsContact O-N 3.15Å
36	S	85.3	Confident	83.5	Confident	65 Å²	65	104.4 Å²	104.4	46%	0.455	58%	0.578	S	S	.	*	S	Bend	trans	-93.6	137.8	178.2	70.2	0	0	0	0	110.5	Y33 P34 S38	Y33-S36 WeakPolarHBondContact CB-OG 3.39Å; Y33-S36 WeakPolarHBondContact O-CB 3.37Å; Y33-S36 PolarHBondContact O-N 2.93Å; Y33-S36 PolarHBondContact O-OG 3.43Å; P34-S36 VanDerWaalsContact C-N 3.33Å; S36-S38 PolarHBondContact O-N 2.99Å
37	D	81.3	Confident	83	Confident	72 Å²	72	106.6 Å²	106.6	39%	0.385	57%	0.574	S	S	.	*			trans	-72.8	113.3	173.9	-179.6	3.1	0	0	0	108.9	N39 A40 K43	D37-N39 PolarHBondContact O-N 3.08Å; D37-N39 VanDerWaalsContact O-N 3.13Å; D37-N39 WeakPolarHBondContact OD1-CB 3.46Å; D37-N39 PolarHBondContact OD1-N 3.37Å; D37-A40 HydrophobicContact CB-CB 4.19Å; D37-A40 WeakPolarHBondContact O-CB 3.45Å; D37-A40 PolarHBondContact O-N 3.32Å; D37-K43 WeakPolarHBondContact OD2-CE 3.45Å; D37-K43 IonicContact OD2-NZ 2.61Å; D37-K43 PolarHBondContact OD2-NZ 3.5Å
38	S	77.8	Confident	82.3	Confident	65 Å²	65	102.8 Å²	102.8	46%	0.455	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.4	-25	177.9	54.8	0	0	0	0	112.7	S36	S36-S38 PolarHBondContact O-N 2.99Å
39	N	79.4	Confident	81.7	Confident	91 Å²	91	107 Å²	107	49%	0.487	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-3.5	176.6	-63.7	-53.1	0	0	0	113.7	D37 V41 F42 K43	D37-N39 PolarHBondContact O-N 3.08Å; D37-N39 VanDerWaalsContact O-N 3.13Å; D37-N39 WeakPolarHBondContact OD1-CB 3.46Å; D37-N39 PolarHBondContact OD1-N 3.37Å; N39-V41 PolarHBondContact O-N 3.04Å; N39-F42 PolarHBondContact O-N 2.94Å; N39-K43 PolarHBondContact O-N 3.46Å
40	A	79.6	Confident	81.1	Confident	53 Å²	53	106.8 Å²	106.8	44%	0.438	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-57.7	-33	-179.1	0	0	0	0	0	112.5	D37 F42 K43	D37-A40 HydrophobicContact CB-CB 4.19Å; D37-A40 WeakPolarHBondContact O-CB 3.45Å; D37-A40 PolarHBondContact O-N 3.32Å; A40-F42 PolarHBondContact O-N 3.06Å; A40-K43 PolarHBondContact O-N 3.14Å; A40-K43 VanDerWaalsContact O-N 3.12Å
41	V	77.8	Confident	80.6	Confident	130 Å²	130	107 Å²	107	79%	0.788	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-60.8	-29.2	177.3	-176.2	0	0	0	0	112.1	N39	N39-V41 PolarHBondContact O-N 3.04Å
42	F	80.9	Confident	79.9	Confident	169 Å²	169	111 Å²	111	74%	0.741	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-92.3	-12.6	179.8	-54.4	-67.4	0	0	0	113.2	N39 A40	N39-F42 PolarHBondContact O-N 2.94Å; A40-F42 PolarHBondContact O-N 3.06Å
43	K	83.4	Confident	79.4	Confident	128 Å²	128	113.3 Å²	113.3	56%	0.557	62%	0.618	S	S	*	*	S	Bend	trans	-76.1	130.5	175.1	-65.9	-177.3	-171.8	175.5	0	108.7	D37 N39 A40	D37-K43 WeakPolarHBondContact OD2-CE 3.45Å; D37-K43 IonicContact OD2-NZ 2.61Å; D37-K43 PolarHBondContact OD2-NZ 3.5Å; N39-K43 PolarHBondContact O-N 3.46Å; A40-K43 PolarHBondContact O-N 3.14Å; A40-K43 VanDerWaalsContact O-N 3.12Å
44	K	81.3	Confident	79.3	Confident	190 Å²	190	110.7 Å²	110.7	83%	0.826	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-61.3	139.1	169.3	-69.4	-174.3	178.8	-176.7	0	108.6	T46	K44-T46 PolarHBondContact O-N 3.32Å
45	P	77.4	Confident	79.6	Confident	126 Å²	126	107.1 Å²	107.1	82%	0.818	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-54.5	126.8	174.8	-23.2	32.3	0	0	0	110.2	E47	P45-E47 PolarHBondContact O-N 2.87Å
46	T	80.9	Confident	79.5	Confident	137 Å²	137	101.8 Å²	101.8	84%	0.84	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-71.3	128.1	172.7	-51.4	0	0	0	0	108.5	K44	K44-T46 PolarHBondContact O-N 3.32Å
47	E	76.8	Confident	79.8	Confident	131 Å²	131	99.3 Å²	99.3	61%	0.612	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-61.5	138.5	172.6	-65.2	-178.9	-159.3	0	0	109.8	P45 S49 Y58	P45-E47 PolarHBondContact O-N 2.87Å; E47-S49 PolarHBondContact O-N 2.96Å; E47-Y58 PolarHBondContact OE2-OH 3.02Å
48	P	75.8	Confident	80.3	Confident	56 Å²	56	99 Å²	99	36%	0.364	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-62.7	136.9	-179.8	24.6	-30.4	0	0	0	109.6	I50 Y58	P48-I50 PolarHBondContact O-N 3.17Å; P48-Y58 VanDerWaalsContact CG-CB 3.49Å; P48-Y58 HydrophobicContact CG-CD1 4.28Å; P48-Y58 HydrophobicContact CG-CD2 4.41Å; P48-Y58 HydrophobicContact CG-CG 3.83Å
49	S	72.1	Confident	81.1	Confident	114 Å²	114	96.3 Å²	96.3	80%	0.797	53%	0.527	S	S	*	.			trans	-59.4	113.8	172.1	46.6	0	0	0	0	109.1	E47 S51	E47-S49 PolarHBondContact O-N 2.96Å; S49-S51 PolarHBondContact O-N 3Å
50	I	70.9	Confident	81.7	Confident	79 Å²	79	92.7 Å²	92.7	41%	0.405	51%	0.509	S	S	.	.			trans	-70.1	101.9	177.4	-57.4	166.5	0	0	0	106.5	P48 W97	P48-I50 PolarHBondContact O-N 3.17Å; I50-W97 HydrophobicContact CD1-CB 4.45Å
51	S	73.1	Confident	82.4	Confident	60 Å²	60	94.6 Å²	94.6	42%	0.42	51%	0.511	S	S	.	.			trans	-81.3	137.3	169.4	65.9	0	0	0	0	108.7	S49 N53 V54	S49-S51 PolarHBondContact O-N 3Å; S51-N53 PolarHBondContact O-N 3.43Å; S51-V54 PolarHBondContact O-N 3.44Å
52	Q	72	Confident	83.2	Confident	169 Å²	169	96.2 Å²	96.2	79%	0.79	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.5	-172.7	-70.4	178.2	-24.5	0	0	113.8	P99	Q52-P99 VanDerWaalsContact O-CB 3.3Å; Q52-P99 WeakPolarHBondContact O-CB 3.3Å
53	N	78.5	Confident	83.8	Confident	128 Å²	128	92.2 Å²	92.2	68%	0.684	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-10.6	-170.6	-64.7	-5.9	0	0	0	114.1	S51	S51-N53 PolarHBondContact O-N 3.43Å
54	V	86.6	Confident	84.4	Confident	94 Å²	94	86.8 Å²	86.8	57%	0.57	48%	0.476	S	S	*	.	S	Bend	trans	-130.3	122.5	-174.8	-174	0	0	0	0	110.2	S51 S56	S51-V54 PolarHBondContact O-N 3.44Å; V54-S56 PolarHBondContact O-N 2.94Å
55	F	90.4	Very high	85.1	Confident	23 Å²	23	82.8 Å²	82.8	10%	0.101	46%	0.46	C	S	.	.			trans	-70.2	113.7	171.2	177	-124.1	0	0	0	110	G57 I59 W97 P99 R142 I145 R146 V149	F55-G57 VanDerWaalsContact C-N 3.25Å; F55-G57 VanDerWaalsContact CZ-CA 3.5Å; F55-G57 PolarHBondContact O-N 3.31Å; F55-I59 HydrophobicContact CZ-CG1 4.36Å; F55-W97 HydrophobicContact CD2-CE3 4.39Å; F55-W97 AromaticContact CE2-CE3 3.68Å; F55-W97 HydrophobicContact CE2-CE3 3.68Å; F55-W97 AromaticContact CE2-CZ3 3.77Å; F55-W97 HydrophobicContact CE2-CZ3 3.77Å; F55-W97 HydrophobicContact CZ-CZ3 4.22Å; F55-P99 HydrophobicContact CB-CG 4.4Å; F55-R142 HydrophobicContact CZ-CG 4.39Å; F55-I145 HydrophobicContact CB-CG2 4.11Å; F55-I145 HydrophobicContact CD1-CB 4.13Å; F55-I145 HydrophobicContact CD1-CG2 3.39Å; F55-I145 HydrophobicContact CD2-CG2 4Å; F55-I145 HydrophobicContact CE1-CB 3.95Å; F55-I145 HydrophobicContact CE1-CD1 4.47Å; F55-I145 HydrophobicContact CE1-CG2 3.67Å; F55-I145 HydrophobicContact CE2-CD1 4.3Å; F55-I145 HydrophobicContact CE2-CG2 4.28Å; F55-I145 HydrophobicContact CG-CG2 3.55Å; F55-I145 HydrophobicContact CZ-CB 4.37Å; F55-I145 HydrophobicContact CZ-CD1 4.05Å; F55-I145 HydrophobicContact CZ-CG2 4.11Å; F55-R146 HydrophobicContact CD1-CG 4.49Å; F55-V149 HydrophobicContact CB-CG2 4.37Å
56	S	88.7	Confident	86.1	Confident	58 Å²	58	78.9 Å²	78.9	41%	0.406	43%	0.432	S	S	.	.			trans	-74.3	-12.1	-177.7	63.3	0	0	0	0	114	V54 Y58	V54-S56 PolarHBondContact O-N 2.94Å; S56-Y58 WeakPolarHBondContact OG-CB 3.35Å; S56-Y58 PolarHBondContact OG-N 3.18Å
57	G	91.2	Very high	86.9	Confident	13 Å²	13	75 Å²	75	13%	0.134	41%	0.41	C	S	.	.	S	Bend	trans	84.5	-7.1	-170.8	0	0	0	0	0	114.1	F55 R142	F55-G57 VanDerWaalsContact C-N 3.25Å; F55-G57 VanDerWaalsContact CZ-CA 3.5Å; F55-G57 PolarHBondContact O-N 3.31Å; G57-R142 PolarHBondContact O-NE 2.89Å
58	Y	91.8	Very high	87.8	Confident	66 Å²	66	73 Å²	73	26%	0.259	40%	0.398	S	S	.	.			trans	-74.4	136.6	172.6	-178.9	-115.2	0	0	0	110.5	E47 P48 S56 P60	E47-Y58 PolarHBondContact OE2-OH 3.02Å; P48-Y58 VanDerWaalsContact CG-CB 3.49Å; P48-Y58 HydrophobicContact CG-CD1 4.28Å; P48-Y58 HydrophobicContact CG-CD2 4.41Å; P48-Y58 HydrophobicContact CG-CG 3.83Å; S56-Y58 WeakPolarHBondContact OG-CB 3.35Å; S56-Y58 PolarHBondContact OG-N 3.18Å; Y58-P60 HydrophobicContact CE1-CB 4.07Å
59	I	94	Very high	88.7	Confident	8 Å²	8	72.4 Å²	72.4	4%	0.041	40%	0.397	C	S	.	.			trans	-131.3	111.6	175.9	-54.5	178.1	0	0	0	106.1	F55 I61 L64 W97 L138 I141 R142	F55-I59 HydrophobicContact CZ-CG1 4.36Å; I59-I61 PolarHBondContact O-N 3.43Å; I59-L64 HydrophobicContact CG2-CD1 3.75Å; I59-L64 HydrophobicContact CG2-CD2 4.08Å; I59-L64 HydrophobicContact CG2-CG 4.18Å; I59-W97 HydrophobicContact CB-CZ3 4.47Å; I59-W97 HydrophobicContact CD1-CH2 4.46Å; I59-W97 HydrophobicContact CD1-CZ3 4.3Å; I59-W97 HydrophobicContact CG1-CE3 4.25Å; I59-W97 HydrophobicContact CG1-CH2 4.24Å; I59-W97 HydrophobicContact CG1-CZ3 3.81Å; I59-W97 HydrophobicContact CG2-CH2 3.92Å; I59-W97 HydrophobicContact CG2-CZ2 3.95Å; I59-W97 HydrophobicContact CG2-CZ3 4.21Å; I59-L138 HydrophobicContact CD1-CD2 4.5Å; I59-L138 HydrophobicContact CG2-CD2 4.49Å; I59-I141 HydrophobicContact CD1-CB 4.2Å; I59-I141 HydrophobicContact CD1-CG2 3.76Å; I59-R142 HydrophobicContact CD1-CG 3.65Å; I59-R142 HydrophobicContact CG1-CG 4.43Å
60	P	92.8	Very high	89.6	Confident	14 Å²	14	72.8 Å²	72.8	9%	0.091	38%	0.382	C	S	.	.			trans	-68.3	115.4	178.7	26.3	-31	0	0	0	109.3	Y58 D62 E63 W97	Y58-P60 HydrophobicContact CE1-CB 4.07Å; P60-D62 PolarHBondContact O-N 2.99Å; P60-E63 HydrophobicContact CB-CG 4.2Å; P60-E63 HydrophobicContact CG-CB 4.06Å; P60-E63 HydrophobicContact CG-CG 3.83Å; P60-E63 PolarHBondContact O-N 3.44Å; P60-W97 VanDerWaalsContact CD-CD1 3.43Å; P60-W97 VanDerWaalsContact CD-CG 3.48Å; P60-W97 HydrophobicContact CG-CB 4.37Å; P60-W97 HydrophobicContact CG-CG 3.92Å
61	I	94	Very high	90.5	Very high	94 Å²	94	69.9 Å²	69.9	48%	0.482	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-62.6	-31	-177.6	-62	173.1	0	0	0	110.8	I59 E63 L64 I66	I59-I61 PolarHBondContact O-N 3.43Å; I61-E63 VanDerWaalsContact C-N 3.25Å; I61-E63 PolarHBondContact O-N 2.98Å; I61-L64 WeakPolarHBondContact O-CB 3.43Å; I61-L64 PolarHBondContact O-N 3.41Å; I61-I66 HydrophobicContact CG2-CD1 4.12Å
62	D	93.8	Very high	91	Very high	163 Å²	163	71.5 Å²	71.5	87%	0.872	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-68	-22.8	-179	-58.2	-29.5	0	0	0	113.2	P60 L64	P60-D62 PolarHBondContact O-N 2.99Å; D62-L64 VanDerWaalsContact C-N 3.31Å
63	E	93.9	Very high	91.4	Very high	85 Å²	85	65.2 Å²	65.2	40%	0.397	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-86.8	-2.2	173.4	-62.3	-170.7	-171.4	0	0	112.8	P60 I61 S96 W97	P60-E63 HydrophobicContact CB-CG 4.2Å; P60-E63 HydrophobicContact CG-CB 4.06Å; P60-E63 HydrophobicContact CG-CG 3.83Å; P60-E63 PolarHBondContact O-N 3.44Å; I61-E63 VanDerWaalsContact C-N 3.25Å; I61-E63 PolarHBondContact O-N 2.98Å; E63-S96 PolarHBondContact OE1-OG 2.92Å; E63-W97 PolarHBondContact OE2-NE1 3.29Å
64	L	96.3	Very high	91.3	Very high	15 Å²	15	65.3 Å²	65.3	8%	0.079	37%	0.368	C	S	.	.	S	Bend	trans	-102.6	133.5	-179.6	-56	-179.2	0	0	0	111.3	I59 I61 D62 I66 I88 F90 W97 L138	I59-L64 HydrophobicContact CG2-CD1 3.75Å; I59-L64 HydrophobicContact CG2-CD2 4.08Å; I59-L64 HydrophobicContact CG2-CG 4.18Å; I61-L64 WeakPolarHBondContact O-CB 3.43Å; I61-L64 PolarHBondContact O-N 3.41Å; D62-L64 VanDerWaalsContact C-N 3.31Å; L64-I66 HydrophobicContact CB-CG1 4.19Å; L64-I88 HydrophobicContact CB-CG2 4.19Å; L64-I88 HydrophobicContact CD1-CG2 4.03Å; L64-I88 HydrophobicContact CD2-CG2 4.25Å; L64-I88 HydrophobicContact CG-CG2 4.4Å; L64-F90 HydrophobicContact CD2-CB 3.71Å; L64-F90 HydrophobicContact CD2-CD1 3.78Å; L64-F90 HydrophobicContact CD2-CG 3.93Å; L64-W97 HydrophobicContact CD2-CZ2 4.5Å; L64-L138 HydrophobicContact CD1-CD2 3.57Å
65	Q	97.2	Very high	90.5	Very high	105 Å²	105	64.2 Å²	64.2	49%	0.491	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	109.8	167.1	-64.3	178.1	-5.6	0	0	108.9	I88 R89	Q65-I88 WeakPolarHBondContact O-CA 3.49Å; Q65-R89 HydrophobicContact CB-CB 4.23Å; Q65-R89 WeakPolarHBondContact CB-O 3.4Å; Q65-R89 PolarHBondContact N-O 3.5Å; Q65-R89 PolarHBondContact O-N 2.98Å
66	I	97.5	Very high	89.9	Confident	45 Å²	45	64.7 Å²	64.7	23%	0.231	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.6	179.9	-52	-176.9	0	0	0	108.8	I61 L64 Y68 V86 E87 I88 Q134	I61-I66 HydrophobicContact CG2-CD1 4.12Å; L64-I66 HydrophobicContact CB-CG1 4.19Å; I66-Y68 HydrophobicContact CG2-CE1 4.48Å; I66-Y68 HydrophobicContact CG2-CE2 4.28Å; I66-V86 HydrophobicContact CG2-CG1 3.86Å; I66-E87 WeakPolarHBondContact CA-O 3.36Å; I66-I88 HydrophobicContact CG1-CG1 4.27Å; I66-I88 HydrophobicContact CG2-CG1 4.48Å; I66-Q134 HydrophobicContact CD1-CG 4.43Å
67	S	97.3	Very high	89.6	Confident	55 Å²	55	69 Å²	69	39%	0.385	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.5	176.7	66.7	0	0	0	0	111.4	E87	S67-E87 PolarHBondContact N-O 3.37Å; S67-E87 PolarHBondContact O-N 2.92Å; S67-E87 WeakPolarHBondContact OG-CB 3.49Å
68	Y	96.3	Very high	88.8	Confident	90 Å²	90	72.1 Å²	72.1	35%	0.353	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134	-176.8	-58	-84	0	0	0	110.5	I66 K85 V86 Q130	I66-Y68 HydrophobicContact CG2-CE1 4.48Å; I66-Y68 HydrophobicContact CG2-CE2 4.28Å; Y68-K85 CarbonylContact C-O 3.56Å; Y68-K85 VanDerWaalsContact CA-O 3.32Å; Y68-K85 WeakPolarHBondContact CA-O 3.45Å; Y68-V86 HydrophobicContact CD1-CG2 3.82Å; Y68-V86 HydrophobicContact CE1-CG1 4.45Å; Y68-V86 HydrophobicContact CE1-CG2 3.76Å; Y68-Q130 HydrophobicContact CD1-CB 4.22Å; Y68-Q130 HydrophobicContact CE1-CB 4Å; Y68-Q130 HydrophobicContact CE1-CG 4.43Å
69	A	94.1	Very high	88.3	Confident	42 Å²	42	70.1 Å²	70.1	35%	0.347	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	169.7	-178.8	0	0	0	0	0	111.3	K83 T84 K85	A69-K83 CarbonylContact O-C 3.16Å; A69-K83 WeakPolarHBondContact O-CA 3.36Å; A69-T84 PolarHBondContact O-N 3.03Å; A69-K85 HydrophobicContact CB-CB 4.28Å; A69-K85 HydrophobicContact CB-CD 4.47Å; A69-K85 HydrophobicContact CB-CG 4.44Å; A69-K85 PolarHBondContact N-O 3.37Å; A69-K85 WeakPolarHBondContact O-CB 3.38Å; A69-K85 PolarHBondContact O-N 2.75Å
70	Y	92	Very high	87.8	Confident	122 Å²	122	75 Å²	75	48%	0.478	43%	0.432	S	S	.	.			trans	-73.6	143.7	169.6	-60.7	-71.5	0	0	0	110.1	V79 N80 K83	Y70-V79 WeakPolarHBondContact CD1-O 3.34Å; Y70-N80 WeakPolarHBondContact CE1-O 3.29Å; Y70-K83 HydrophobicContact CD1-CG 4.05Å; Y70-K83 HydrophobicContact CE1-CG 3.81Å; Y70-K83 HydrophobicContact CE2-CG 4.34Å; Y70-K83 HydrophobicContact CG-CG 4.44Å
71	S	88.3	Confident	87.4	Confident	18 Å²	18	81 Å²	81	13%	0.126	46%	0.457	C	S	.	.			trans	-67.9	145.8	176.1	56.4	0	0	0	0	111	G73 V79	S71-G73 PolarHBondContact O-N 3.17Å; S71-V79 WeakPolarHBondContact O-CG1 3.43Å; S71-V79 WeakPolarHBondContact OG-CG1 3.4Å
72	S	84.5	Confident	87.1	Confident	95 Å²	95	80.4 Å²	80.4	66%	0.664	46%	0.455	S	S	*	.			trans	-82.2	7.3	-177.2	38.8	0	0	0	0	115.1	D125	S72-D125 PolarHBondContact OG-OD2 3.11Å
73	G	81.1	Confident	87	Confident	36 Å²	36	78 Å²	78	37%	0.371	44%	0.436	S	S	.	.	S	Bend	trans	-69.9	165.6	-176.8	0	0	0	0	0	114.4	S71 G75	S71-G73 PolarHBondContact O-N 3.17Å; G73-G75 PolarHBondContact O-N 3Å
74	P	75.9	Confident	87	Confident	131 Å²	131	74.2 Å²	74.2	85%	0.851	42%	0.419	S	S	*	.	S	Bend	trans	-54.4	132.3	178.8	23.2	-33.1	0	0	0	110.9	G76	P74-G76 PolarHBondContact O-N 3.49Å
75	G	69.2	Low	87	Confident	71 Å²	71	75.9 Å²	75.9	73%	0.732	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-52.9	133.7	-167.8	0	0	0	0	0	113.7	G73	G73-G75 PolarHBondContact O-N 3Å
76	G	78.7	Confident	87	Confident	32 Å²	32	70.9 Å²	70.9	33%	0.33	40%	0.402	S	S	.	.			trans	-158.1	165.5	175.4	0	0	0	0	0	110.1	P74 H78 V79 N80	P74-G76 PolarHBondContact O-N 3.49Å; G76-H78 PolarHBondContact O-N 2.85Å; G76-H78 VanDerWaalsContact O-N 3.1Å; G76-V79 PolarHBondContact O-N 2.93Å; G76-V79 VanDerWaalsContact O-N 3.14Å; G76-N80 PolarHBondContact O-N 3.22Å
77	Q	81	Confident	87	Confident	149 Å²	149	71 Å²	71	70%	0.696	40%	0.402	S	S	*	.	H	α-helix	trans	-55.4	-35	-176.6	-65.4	-166.9	24.1	0	0	112.7	K81	Q77-K81 WeakPolarHBondContact O-CB 3.49Å; Q77-K81 VanDerWaalsContact O-CD 3.3Å; Q77-K81 WeakPolarHBondContact O-CD 3.48Å; Q77-K81 WeakPolarHBondContact O-CG 3.48Å; Q77-K81 PolarHBondContact O-N 2.97Å; Q77-K81 VanDerWaalsContact OE1-NZ 3.14Å
78	H	75.3	Confident	87	Confident	79 Å²	79	68.3 Å²	68.3	37%	0.366	38%	0.383	S	S	.	.	H	α-helix	trans	-70.8	-44.3	-179.6	-175.5	63.1	0	0	0	112.6	G76 N80 K81 N82 R128	G76-H78 PolarHBondContact O-N 2.85Å; G76-H78 VanDerWaalsContact O-N 3.1Å; H78-N80 VanDerWaalsContact C-N 3.26Å; H78-N80 PolarHBondContact O-N 3.27Å; H78-K81 PolarHBondContact O-N 2.93Å; H78-N82 PolarHBondContact O-N 3.43Å; H78-N82 VanDerWaalsContact O-N 3.14Å; H78-R128 WeakPolarHBondContact NE2-CB 3.36Å
79	V	81.6	Confident	87.1	Confident	24 Å²	24	67.9 Å²	67.9	15%	0.145	38%	0.381	C	S	.	.	H	α-helix	trans	-60.1	-37.4	-178.8	174.6	0	0	0	0	111.4	Y70 S71 G76	Y70-V79 WeakPolarHBondContact CD1-O 3.34Å; S71-V79 WeakPolarHBondContact O-CG1 3.43Å; S71-V79 WeakPolarHBondContact OG-CG1 3.4Å; G76-V79 PolarHBondContact O-N 2.93Å; G76-V79 VanDerWaalsContact O-N 3.14Å
80	N	82.7	Confident	87.2	Confident	111 Å²	111	66 Å²	66	59%	0.594	37%	0.365	S	S	*	.	H	α-helix	trans	-85.6	-16.6	-177	-64.9	-10.8	0	0	0	113.7	Y70 G76 H78	Y70-N80 WeakPolarHBondContact CE1-O 3.29Å; G76-N80 PolarHBondContact O-N 3.22Å; H78-N80 VanDerWaalsContact C-N 3.26Å; H78-N80 PolarHBondContact O-N 3.27Å
81	K	84.2	Confident	87.5	Confident	139 Å²	139	62.8 Å²	62.8	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-99.2	-31.6	-175	-72.8	175.4	-177.4	177.1	0	113.3	Q77 H78	Q77-K81 WeakPolarHBondContact O-CB 3.49Å; Q77-K81 VanDerWaalsContact O-CD 3.3Å; Q77-K81 WeakPolarHBondContact O-CD 3.48Å; Q77-K81 WeakPolarHBondContact O-CG 3.48Å; Q77-K81 PolarHBondContact O-N 2.97Å; Q77-K81 VanDerWaalsContact OE1-NZ 3.14Å; H78-K81 PolarHBondContact O-N 2.93Å
82	N	88.4	Confident	87.8	Confident	82 Å²	82	62 Å²	62	44%	0.439	35%	0.348	S	S	.	.			trans	-121.1	128	-171.6	-70.3	63.7	0	0	0	111.1	H78 T84	H78-N82 PolarHBondContact O-N 3.43Å; H78-N82 VanDerWaalsContact O-N 3.14Å; N82-T84 VanDerWaalsContact C-N 3.27Å; N82-T84 HydrophobicContact CB-CG2 3.87Å; N82-T84 PolarHBondContact O-N 3.39Å
83	K	92.4	Very high	88.3	Confident	111 Å²	111	60 Å²	60	48%	0.483	33%	0.334	S	S	.	.			trans	-78.6	76.8	172.6	-65.7	-177.7	178.7	-175.2	0	110.3	A69 Y70	A69-K83 CarbonylContact O-C 3.16Å; A69-K83 WeakPolarHBondContact O-CA 3.36Å; Y70-K83 HydrophobicContact CD1-CG 4.05Å; Y70-K83 HydrophobicContact CE1-CG 3.81Å; Y70-K83 HydrophobicContact CE2-CG 4.34Å; Y70-K83 HydrophobicContact CG-CG 4.44Å
84	T	93.5	Very high	88.9	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.037	35%	0.345	C	S	.	.			trans	-84.2	-27	-175.9	54	0	0	0	0	113.1	A69 N82 R128 N133	A69-T84 PolarHBondContact O-N 3.03Å; N82-T84 VanDerWaalsContact C-N 3.27Å; N82-T84 HydrophobicContact CB-CG2 3.87Å; N82-T84 PolarHBondContact O-N 3.39Å; T84-R128 VanDerWaalsContact CG2-O 3.25Å; T84-R128 WeakPolarHBondContact CG2-O 3.18Å; T84-N133 PolarHBondContact O-ND2 3Å
85	K	95.7	Very high	89.8	Confident	50 Å²	50	56.2 Å²	56.2	22%	0.217	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	131	179.2	179.2	169.9	-178.4	172.8	0	109.7	Y68 A69 S124 D125	Y68-K85 CarbonylContact C-O 3.56Å; Y68-K85 VanDerWaalsContact CA-O 3.32Å; Y68-K85 WeakPolarHBondContact CA-O 3.45Å; A69-K85 HydrophobicContact CB-CB 4.28Å; A69-K85 HydrophobicContact CB-CD 4.47Å; A69-K85 HydrophobicContact CB-CG 4.44Å; A69-K85 PolarHBondContact N-O 3.37Å; A69-K85 WeakPolarHBondContact O-CB 3.38Å; A69-K85 PolarHBondContact O-N 2.75Å; K85-S124 WeakPolarHBondContact CA-O 3.32Å; K85-D125 HydrophobicContact CB-CB 3.89Å; K85-D125 HydrophobicContact CD-CB 4.31Å; K85-D125 HydrophobicContact CG-CB 3.97Å
86	V	97.3	Very high	90.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.5	177.9	-177.7	0	0	0	0	108.8	I66 Y68 I88 T123 S124 Q130 N133 Q134	I66-V86 HydrophobicContact CG2-CG1 3.86Å; Y68-V86 HydrophobicContact CD1-CG2 3.82Å; Y68-V86 HydrophobicContact CE1-CG1 4.45Å; Y68-V86 HydrophobicContact CE1-CG2 3.76Å; V86-I88 HydrophobicContact CG1-CG1 4.09Å; V86-T123 CarbonylContact O-C 3.53Å; V86-T123 WeakPolarHBondContact O-CA 3.45Å; V86-S124 PolarHBondContact N-O 3.14Å; V86-S124 PolarHBondContact O-N 3.1Å; V86-Q130 WeakPolarHBondContact CG2-O 3.16Å; V86-N133 HydrophobicContact CB-CB 4.26Å; V86-N133 HydrophobicContact CG2-CB 3.72Å; V86-Q134 HydrophobicContact CG1-CB 4.19Å; V86-Q134 HydrophobicContact CG1-CG 4.49Å; V86-Q134 HydrophobicContact CG2-CB 4.34Å
87	E	97.6	Very high	91.4	Very high	47 Å²	47	54.8 Å²	54.8	22%	0.22	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.9	167.7	175.6	177.5	145.2	0	0	108.6	I66 S67 R89 I121 I122 T123	I66-E87 WeakPolarHBondContact CA-O 3.36Å; S67-E87 PolarHBondContact N-O 3.37Å; S67-E87 PolarHBondContact O-N 2.92Å; S67-E87 WeakPolarHBondContact OG-CB 3.49Å; E87-R89 IonicContact OE1-CZ 2.78Å; E87-R89 IonicContact OE1-NE 2.82Å; E87-R89 IonicContact OE1-NH2 3.61Å; E87-R89 PolarHBondContact OE1-NH2 3.46Å; E87-I121 HydrophobicContact CG-CG2 3.8Å; E87-I122 WeakPolarHBondContact CA-O 3.37Å; E87-T123 HydrophobicContact CB-CG2 3.8Å; E87-T123 HydrophobicContact CG-CG2 3.85Å
88	I	97.9	Very high	92	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.8	171.8	-58.9	-170.3	0	0	0	108	L64 Q65 I66 V86 I122 Q134 C137 L138 I141	L64-I88 HydrophobicContact CB-CG2 4.19Å; L64-I88 HydrophobicContact CD1-CG2 4.03Å; L64-I88 HydrophobicContact CD2-CG2 4.25Å; L64-I88 HydrophobicContact CG-CG2 4.4Å; Q65-I88 WeakPolarHBondContact O-CA 3.49Å; I66-I88 HydrophobicContact CG1-CG1 4.27Å; I66-I88 HydrophobicContact CG2-CG1 4.48Å; V86-I88 HydrophobicContact CG1-CG1 4.09Å; I88-I122 HydrophobicContact CB-CG2 3.93Å; I88-I122 PolarHBondContact N-O 3.31Å; I88-I122 PolarHBondContact O-N 3.14Å; I88-Q134 HydrophobicContact CD1-CG 4.38Å; I88-C137 HydrophobicContact CB-CB 4.49Å; I88-C137 HydrophobicContact CD1-CB 3.44Å; I88-C137 VanDerWaalsContact CD1-CB 3.44Å; I88-C137 HydrophobicContact CG1-CB 3.84Å; I88-L138 HydrophobicContact CD1-CD2 3.89Å; I88-L138 HydrophobicContact CD1-CG 3.97Å; I88-I141 HydrophobicContact CB-CD1 4.48Å; I88-I141 HydrophobicContact CG2-CD1 3.95Å
89	R	97.2	Very high	92.8	Very high	80 Å²	80	44.5 Å²	44.5	30%	0.302	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.3	178	179	-176.6	-55.5	-178.5	5.4	110.5	Q65 E87 Y119 F120 I121	Q65-R89 HydrophobicContact CB-CB 4.23Å; Q65-R89 WeakPolarHBondContact CB-O 3.4Å; Q65-R89 PolarHBondContact N-O 3.5Å; Q65-R89 PolarHBondContact O-N 2.98Å; E87-R89 IonicContact OE1-CZ 2.78Å; E87-R89 IonicContact OE1-NE 2.82Å; E87-R89 IonicContact OE1-NH2 3.61Å; E87-R89 PolarHBondContact OE1-NH2 3.46Å; R89-Y119 HydrophobicContact CG-CD1 3.64Å; R89-Y119 HydrophobicContact CG-CG 4.12Å; R89-F120 VanDerWaalsContact CA-O 3.27Å; R89-F120 WeakPolarHBondContact CA-O 3.46Å; R89-I121 HydrophobicContact CB-CG1 4.41Å; R89-I121 HydrophobicContact CG-CG1 4.06Å
90	F	97.4	Very high	93.3	Very high	3 Å²	3	48.7 Å²	48.7	1%	0.013	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	156.4	170.1	66.8	-89.3	0	0	0	111.1	L64 V92 A95 W97 I98 F106 Y119 F120 I141	L64-F90 HydrophobicContact CD2-CB 3.71Å; L64-F90 HydrophobicContact CD2-CD1 3.78Å; L64-F90 HydrophobicContact CD2-CG 3.93Å; F90-V92 HydrophobicContact CD2-CG2 4.45Å; F90-V92 HydrophobicContact CE2-CB 4.48Å; F90-V92 HydrophobicContact CE2-CG2 3.91Å; F90-A95 HydrophobicContact CD2-CB 4.32Å; F90-A95 HydrophobicContact CE2-CB 4.46Å; F90-W97 HydrophobicContact CD2-CZ2 4.17Å; F90-W97 HydrophobicContact CE1-CZ2 4.5Å; F90-W97 HydrophobicContact CE2-CH2 4.38Å; F90-W97 AromaticContact CE2-CZ2 3.98Å; F90-W97 HydrophobicContact CE2-CZ2 3.98Å; F90-W97 HydrophobicContact CZ-CH2 4.17Å; F90-W97 HydrophobicContact CZ-CZ2 4.16Å; F90-I98 HydrophobicContact CE2-CD1 3.93Å; F90-I98 HydrophobicContact CZ-CD1 4.32Å; F90-F106 HydrophobicContact CZ-CE1 4.48Å; F90-F106 HydrophobicContact CZ-CZ 4.26Å; F90-Y119 WeakPolarHBondContact O-CA 3.23Å; F90-F120 HydrophobicContact CD1-CD1 4.26Å; F90-F120 HydrophobicContact CE1-CB 4.18Å; F90-F120 AromaticContact CE1-CD1 3.49Å; F90-F120 HydrophobicContact CE1-CD1 3.49Å; F90-F120 VanDerWaalsContact CE1-CD1 3.49Å; F90-F120 HydrophobicContact CE1-CE1 4.28Å; F90-F120 HydrophobicContact CE1-CG 4.21Å; F90-F120 HydrophobicContact CZ-CB 4.11Å; F90-F120 AromaticContact CZ-CD1 3.94Å; F90-F120 HydrophobicContact CZ-CD1 3.94Å; F90-F120 HydrophobicContact CZ-CG 4.29Å; F90-F120 PolarHBondContact N-O 3.09Å; F90-F120 PolarHBondContact O-N 3.24Å; F90-I141 HydrophobicContact CE1-CD1 4.22Å; F90-I141 HydrophobicContact CE1-CG2 4.38Å
91	H	97	Very high	93.7	Very high	55 Å²	55	49.8 Å²	49.8	26%	0.255	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.7	177.7	-175.4	-116.2	0	0	0	109.7	S94 A95 E117 Y119	H91-S94 PolarHBondContact CE1-OG 3.1Å; H91-S94 VanDerWaalsContact ND1-CB 3.31Å; H91-S94 WeakPolarHBondContact ND1-CB 3.46Å; H91-S94 PolarHBondContact ND1-N 3.29Å; H91-S94 PolarHBondContact ND1-OG 3.14Å; H91-S94 PolarHBondContact O-N 2.76Å; H91-A95 PolarHBondContact O-N 3.28Å; H91-E117 PolarHBondContact CD2-O 3.35Å; H91-E117 PolarHBondContact NE2-O 2.7Å; H91-Y119 HydrophobicContact CB-CD1 4.04Å; H91-Y119 HydrophobicContact CB-CE1 3.72Å
92	V	95.8	Very high	94.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-45.4	-171.6	-177.9	0	0	0	0	112.7	F90 S94 A95 F106 M107 I114 N118 F120	F90-V92 HydrophobicContact CD2-CG2 4.45Å; F90-V92 HydrophobicContact CE2-CB 4.48Å; F90-V92 HydrophobicContact CE2-CG2 3.91Å; V92-S94 VanDerWaalsContact C-N 3.33Å; V92-S94 PolarHBondContact O-N 2.94Å; V92-A95 WeakPolarHBondContact O-CB 3.43Å; V92-A95 PolarHBondContact O-N 3.26Å; V92-F106 HydrophobicContact CG1-CD1 3.85Å; V92-F106 HydrophobicContact CG1-CE1 4.23Å; V92-F106 HydrophobicContact CG2-CD1 4.22Å; V92-F106 HydrophobicContact CG2-CE1 3.8Å; V92-M107 HydrophobicContact CB-CG 4.45Å; V92-M107 HydrophobicContact CG1-CG 3.87Å; V92-M107 HydrophobicContact CG1-SD 4.35Å; V92-I114 HydrophobicContact CG2-CD1 4.41Å; V92-N118 PolarHBondContact N-O 2.8Å; V92-F120 HydrophobicContact CG2-CB 3.63Å
93	P	94.4	Very high	94.5	Very high	54 Å²	54	40.6 Å²	40.6	35%	0.351	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-34.8	-179.6	-23.8	34.4	0	0	0	113.9	A95 N118	P93-A95 VanDerWaalsContact C-N 3.34Å; P93-N118 HydrophobicContact CG-CB 3.79Å
94	S	94.1	Very high	94.5	Very high	86 Å²	86	41.9 Å²	41.9	60%	0.601	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-13.8	-178.7	-65.1	0	0	0	0	114	H91 V92 S96	H91-S94 PolarHBondContact CE1-OG 3.1Å; H91-S94 VanDerWaalsContact ND1-CB 3.31Å; H91-S94 WeakPolarHBondContact ND1-CB 3.46Å; H91-S94 PolarHBondContact ND1-N 3.29Å; H91-S94 PolarHBondContact ND1-OG 3.14Å; H91-S94 PolarHBondContact O-N 2.76Å; V92-S94 VanDerWaalsContact C-N 3.33Å; V92-S94 PolarHBondContact O-N 2.94Å; S94-S96 PolarHBondContact O-N 3.37Å
95	A	93.7	Very high	94.5	Very high	2 Å²	2	43.1 Å²	43.1	2%	0.017	22%	0.224	C	C	.	.			trans	-68.1	103.7	-177.4	0	0	0	0	0	111.2	F90 H91 V92 P93 W97 I98 K103	F90-A95 HydrophobicContact CD2-CB 4.32Å; F90-A95 HydrophobicContact CE2-CB 4.46Å; H91-A95 PolarHBondContact O-N 3.28Å; V92-A95 WeakPolarHBondContact O-CB 3.43Å; V92-A95 PolarHBondContact O-N 3.26Å; P93-A95 VanDerWaalsContact C-N 3.34Å; A95-W97 VanDerWaalsContact C-N 3.28Å; A95-W97 HydrophobicContact CB-CZ2 4.29Å; A95-W97 PolarHBondContact O-N 3.48Å; A95-I98 HydrophobicContact CB-CD1 3.96Å; A95-I98 HydrophobicContact CB-CG1 4.13Å; A95-K103 WeakPolarHBondContact O-CE 3.46Å; A95-K103 PolarHBondContact O-NZ 3.34Å
96	S	91.2	Very high	94.5	Very high	70 Å²	70	40.7 Å²	40.7	49%	0.49	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-22.4	-177.4	65.9	0	0	0	0	113.5	E63 S94 I98	E63-S96 PolarHBondContact OE1-OG 2.92Å; S94-S96 PolarHBondContact O-N 3.37Å; S96-I98 VanDerWaalsContact C-N 3.32Å; S96-I98 PolarHBondContact O-N 2.82Å
97	W	91.9	Very high	94.4	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.011	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-5.9	-177.3	55.3	-88.4	0	0	0	114.1	I50 F55 I59 P60 E63 L64 F90 A95 I141 I145	I50-W97 HydrophobicContact CD1-CB 4.45Å; F55-W97 HydrophobicContact CD2-CE3 4.39Å; F55-W97 AromaticContact CE2-CE3 3.68Å; F55-W97 HydrophobicContact CE2-CE3 3.68Å; F55-W97 AromaticContact CE2-CZ3 3.77Å; F55-W97 HydrophobicContact CE2-CZ3 3.77Å; F55-W97 HydrophobicContact CZ-CZ3 4.22Å; I59-W97 HydrophobicContact CB-CZ3 4.47Å; I59-W97 HydrophobicContact CD1-CH2 4.46Å; I59-W97 HydrophobicContact CD1-CZ3 4.3Å; I59-W97 HydrophobicContact CG1-CE3 4.25Å; I59-W97 HydrophobicContact CG1-CH2 4.24Å; I59-W97 HydrophobicContact CG1-CZ3 3.81Å; I59-W97 HydrophobicContact CG2-CH2 3.92Å; I59-W97 HydrophobicContact CG2-CZ2 3.95Å; I59-W97 HydrophobicContact CG2-CZ3 4.21Å; P60-W97 VanDerWaalsContact CD-CD1 3.43Å; P60-W97 VanDerWaalsContact CD-CG 3.48Å; P60-W97 HydrophobicContact CG-CB 4.37Å; P60-W97 HydrophobicContact CG-CG 3.92Å; E63-W97 PolarHBondContact OE2-NE1 3.29Å; L64-W97 HydrophobicContact CD2-CZ2 4.5Å; F90-W97 HydrophobicContact CD2-CZ2 4.17Å; F90-W97 HydrophobicContact CE1-CZ2 4.5Å; F90-W97 HydrophobicContact CE2-CH2 4.38Å; F90-W97 AromaticContact CE2-CZ2 3.98Å; F90-W97 HydrophobicContact CE2-CZ2 3.98Å; F90-W97 HydrophobicContact CZ-CH2 4.17Å; F90-W97 HydrophobicContact CZ-CZ2 4.16Å; A95-W97 VanDerWaalsContact C-N 3.28Å; A95-W97 HydrophobicContact CB-CZ2 4.29Å; A95-W97 PolarHBondContact O-N 3.48Å; W97-I141 HydrophobicContact CH2-CG2 4.01Å; W97-I145 HydrophobicContact CE3-CD1 4.44Å; W97-I145 HydrophobicContact CH2-CD1 3.69Å; W97-I145 HydrophobicContact CZ3-CD1 3.32Å
98	I	93.4	Very high	94.3	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	25%	0.249	C	C	.	.	S	Bend	trans	-102.8	129	173.9	-52.8	178.8	0	0	0	108.5	F90 A95 S96 V102 K103 I145	F90-I98 HydrophobicContact CE2-CD1 3.93Å; F90-I98 HydrophobicContact CZ-CD1 4.32Å; A95-I98 HydrophobicContact CB-CD1 3.96Å; A95-I98 HydrophobicContact CB-CG1 4.13Å; S96-I98 VanDerWaalsContact C-N 3.32Å; S96-I98 PolarHBondContact O-N 2.82Å; I98-V102 HydrophobicContact CG2-CB 4.09Å; I98-V102 HydrophobicContact CG2-CG1 4.04Å; I98-K103 HydrophobicContact CB-CG 3.91Å; I98-K103 HydrophobicContact CG2-CG 3.64Å; I98-K103 WeakPolarHBondContact O-CE 3.48Å; I98-I145 HydrophobicContact CD1-CD1 4.08Å; I98-I145 HydrophobicContact CG1-CD1 4.24Å
99	P	92.5	Very high	94.1	Very high	8 Å²	8	52.3 Å²	52.3	5%	0.052	27%	0.268	C	S	.	.			trans	-58.3	140.7	172	-27.5	36.9	0	0	0	112.5	Q52 F55 Q101 V102 K103	Q52-P99 VanDerWaalsContact O-CB 3.3Å; Q52-P99 WeakPolarHBondContact O-CB 3.3Å; F55-P99 HydrophobicContact CB-CG 4.4Å; P99-Q101 VanDerWaalsContact C-N 3.32Å; P99-Q101 PolarHBondContact O-N 3.32Å; P99-V102 HydrophobicContact CB-CB 4.24Å; P99-V102 HydrophobicContact CB-CG2 3.9Å; P99-V102 HydrophobicContact CG-CG2 4.19Å; P99-V102 WeakPolarHBondContact O-CA 3.43Å; P99-V102 WeakPolarHBondContact O-CB 3.37Å; P99-V102 PolarHBondContact O-N 2.91Å; P99-K103 PolarHBondContact O-N 3.12Å
100	D	91.7	Very high	94.1	Very high	112 Å²	112	50 Å²	50	60%	0.599	26%	0.26	S	S	*	.	H	α-helix	trans	-62.4	-35.9	-173.8	-68	-33.2	0	0	0	113.5	V102 K103 Q104	D100-V102 VanDerWaalsContact C-N 3.26Å; D100-V102 PolarHBondContact O-N 3.22Å; D100-K103 PolarHBondContact O-N 3.24Å; D100-K103 IonicContact OD1-NZ 3.62Å; D100-K103 PolarHBondContact OD1-NZ 3.41Å; D100-Q104 PolarHBondContact O-N 2.63Å
101	Q	90.8	Very high	94	Very high	134 Å²	134	52.4 Å²	52.4	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-60.9	-37.6	173.3	-66	-178.3	-23.2	0	0	111.9	P99 L152	P99-Q101 VanDerWaalsContact C-N 3.32Å; P99-Q101 PolarHBondContact O-N 3.32Å; Q101-L152 HydrophobicContact CB-CD1 4.05Å
102	V	94	Very high	93.9	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.03	31%	0.311	C	S	.	.	H	α-helix	trans	-75.1	-35.7	179.3	-179.4	0	0	0	0	110.6	I98 P99 D100 Q104 L105 F106 I145 C148 V149 L152	I98-V102 HydrophobicContact CG2-CB 4.09Å; I98-V102 HydrophobicContact CG2-CG1 4.04Å; P99-V102 HydrophobicContact CB-CB 4.24Å; P99-V102 HydrophobicContact CB-CG2 3.9Å; P99-V102 HydrophobicContact CG-CG2 4.19Å; P99-V102 WeakPolarHBondContact O-CA 3.43Å; P99-V102 WeakPolarHBondContact O-CB 3.37Å; P99-V102 PolarHBondContact O-N 2.91Å; D100-V102 VanDerWaalsContact C-N 3.26Å; D100-V102 PolarHBondContact O-N 3.22Å; V102-Q104 VanDerWaalsContact C-N 3.34Å; V102-Q104 PolarHBondContact O-N 2.77Å; V102-L105 PolarHBondContact O-N 2.98Å; V102-F106 WeakPolarHBondContact O-CB 3.39Å; V102-F106 PolarHBondContact O-N 3.32Å; V102-I145 HydrophobicContact CG1-CG2 4Å; V102-C148 HydrophobicContact CG1-CB 3.74Å; V102-V149 HydrophobicContact CG1-CG2 4.24Å; V102-V149 HydrophobicContact CG2-CG2 3.59Å; V102-L152 HydrophobicContact CB-CD1 4.49Å; V102-L152 HydrophobicContact CG2-CD1 3.76Å
103	K	94.2	Very high	93.9	Very high	23 Å²	23	63 Å²	63	10%	0.1	33%	0.331	C	S	.	.	H	α-helix	trans	-57.4	-46	177	-70.3	179.7	-170.9	158.1	0	112.1	A95 I98 P99 D100 F106 M107	A95-K103 WeakPolarHBondContact O-CE 3.46Å; A95-K103 PolarHBondContact O-NZ 3.34Å; I98-K103 HydrophobicContact CB-CG 3.91Å; I98-K103 HydrophobicContact CG2-CG 3.64Å; I98-K103 WeakPolarHBondContact O-CE 3.48Å; P99-K103 PolarHBondContact O-N 3.12Å; D100-K103 PolarHBondContact O-N 3.24Å; D100-K103 IonicContact OD1-NZ 3.62Å; D100-K103 PolarHBondContact OD1-NZ 3.41Å; K103-F106 PolarHBondContact O-N 3.42Å; K103-M107 VanDerWaalsContact O-CG 3.31Å; K103-M107 WeakPolarHBondContact O-CG 3.39Å; K103-M107 PolarHBondContact O-N 2.75Å
104	Q	93.1	Very high	94	Very high	137 Å²	137	61.8 Å²	61.8	64%	0.64	32%	0.321	S	S	*	.	H	α-helix	trans	-60.5	-52.3	-179.6	-68.3	178.8	-7.7	0	0	110.8	D100 V102 F106 M107 E108	D100-Q104 PolarHBondContact O-N 2.63Å; V102-Q104 VanDerWaalsContact C-N 3.34Å; V102-Q104 PolarHBondContact O-N 2.77Å; Q104-F106 VanDerWaalsContact C-N 3.31Å; Q104-F106 PolarHBondContact O-N 2.71Å; Q104-M107 PolarHBondContact O-N 2.92Å; Q104-E108 WeakPolarHBondContact O-CG 3.3Å; Q104-E108 PolarHBondContact O-N 3.48Å; Q104-E108 VanDerWaalsContact O-N 3.09Å
105	L	94	Very high	94.1	Very high	32 Å²	32	61.3 Å²	61.3	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-36.8	178.2	-173.4	67.3	0	0	0	112.5	V102 E108 K109 C148 L152	V102-L105 PolarHBondContact O-N 2.98Å; L105-E108 PolarHBondContact O-N 2.88Å; L105-K109 HydrophobicContact CD1-CD 4.49Å; L105-K109 HydrophobicContact CD1-CG 4.37Å; L105-K109 HydrophobicContact CG-CD 4.16Å; L105-K109 HydrophobicContact CG-CG 4.36Å; L105-K109 WeakPolarHBondContact O-CB 3.48Å; L105-K109 WeakPolarHBondContact O-CG 3.26Å; L105-K109 PolarHBondContact O-N 3.33Å; L105-C148 HydrophobicContact CD2-CB 4.09Å; L105-C148 VanDerWaalsContact CD2-O 3.25Å; L105-C148 WeakPolarHBondContact CD2-O 3.25Å; L105-C148 HydrophobicContact CG-CB 4.49Å; L105-L152 HydrophobicContact CB-CD2 4.45Å; L105-L152 HydrophobicContact CD2-CD2 3.9Å; L105-L152 HydrophobicContact CD2-CG 3.76Å
106	F	95.7	Very high	94.1	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-44.7	175.9	179.2	-87.8	0	0	0	111	F90 V92 V102 K103 Q104 E108 K109 E110 I114 F120 I144 I145	F90-F106 HydrophobicContact CZ-CE1 4.48Å; F90-F106 HydrophobicContact CZ-CZ 4.26Å; V92-F106 HydrophobicContact CG1-CD1 3.85Å; V92-F106 HydrophobicContact CG1-CE1 4.23Å; V92-F106 HydrophobicContact CG2-CD1 4.22Å; V92-F106 HydrophobicContact CG2-CE1 3.8Å; V102-F106 WeakPolarHBondContact O-CB 3.39Å; V102-F106 PolarHBondContact O-N 3.32Å; K103-F106 PolarHBondContact O-N 3.42Å; Q104-F106 VanDerWaalsContact C-N 3.31Å; Q104-F106 PolarHBondContact O-N 2.71Å; F106-E108 VanDerWaalsContact C-N 3.3Å; F106-E108 PolarHBondContact O-N 3.36Å; F106-K109 PolarHBondContact O-N 3.4Å; F106-E110 HydrophobicContact CD2-CG 4.49Å; F106-E110 HydrophobicContact CE2-CG 4.24Å; F106-E110 HydrophobicContact CZ-CG 4.41Å; F106-E110 WeakPolarHBondContact O-CB 3.42Å; F106-E110 PolarHBondContact O-N 3.21Å; F106-I114 HydrophobicContact CD1-CD1 4.35Å; F106-I114 HydrophobicContact CE1-CD1 4.25Å; F106-F120 HydrophobicContact CE1-CB 4.11Å; F106-F120 AromaticContact CE1-CD2 3.72Å; F106-F120 HydrophobicContact CE1-CD2 3.72Å; F106-F120 HydrophobicContact CE1-CE2 4.27Å; F106-F120 AromaticContact CE1-CG 3.91Å; F106-F120 HydrophobicContact CE1-CG 3.91Å; F106-F120 HydrophobicContact CZ-CB 4.37Å; F106-F120 HydrophobicContact CZ-CD1 4.07Å; F106-F120 AromaticContact CZ-CD2 3.54Å; F106-F120 HydrophobicContact CZ-CD2 3.54Å; F106-F120 HydrophobicContact CZ-CE1 4.18Å; F106-F120 AromaticContact CZ-CE2 3.68Å; F106-F120 HydrophobicContact CZ-CE2 3.68Å; F106-F120 AromaticContact CZ-CG 3.73Å; F106-F120 HydrophobicContact CZ-CG 3.73Å; F106-F120 AromaticContact CZ-CZ 4Å; F106-F120 HydrophobicContact CZ-CZ 4Å; F106-I144 HydrophobicContact CD2-CG2 3.73Å; F106-I144 HydrophobicContact CE2-CB 4.29Å; F106-I144 HydrophobicContact CE2-CG2 3.45Å; F106-I144 VanDerWaalsContact CE2-CG2 3.45Å; F106-I145 HydrophobicContact CD2-CG1 4.19Å; F106-I145 HydrophobicContact CE2-CG1 4.15Å
107	M	95.6	Very high	94.3	Very high	61 Å²	61	74.6 Å²	74.6	30%	0.3	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-36.9	176.5	-72.6	-178.6	67.4	0	0	112.4	V92 K103 Q104 A111 I114	V92-M107 HydrophobicContact CB-CG 4.45Å; V92-M107 HydrophobicContact CG1-CG 3.87Å; V92-M107 HydrophobicContact CG1-SD 4.35Å; K103-M107 VanDerWaalsContact O-CG 3.31Å; K103-M107 WeakPolarHBondContact O-CG 3.39Å; K103-M107 PolarHBondContact O-N 2.75Å; Q104-M107 PolarHBondContact O-N 2.92Å; M107-A111 WeakPolarHBondContact O-CA 3.36Å; M107-A111 WeakPolarHBondContact O-CB 3.37Å; M107-A111 PolarHBondContact O-N 2.98Å; M107-I114 HydrophobicContact CB-CD1 4.28Å; M107-I114 HydrophobicContact CG-CD1 4.13Å
108	E	94.5	Very high	94.5	Very high	142 Å²	142	77.2 Å²	77.2	66%	0.664	38%	0.377	S	S	*	.	H	α-helix	trans	-69.9	-48.1	176	-69.8	175.1	-178.5	0	0	112.3	Q104 L105 F106	Q104-E108 WeakPolarHBondContact O-CG 3.3Å; Q104-E108 PolarHBondContact O-N 3.48Å; Q104-E108 VanDerWaalsContact O-N 3.09Å; L105-E108 PolarHBondContact O-N 2.88Å; F106-E108 VanDerWaalsContact C-N 3.3Å; F106-E108 PolarHBondContact O-N 3.36Å
109	K	94.7	Very high	94.7	Very high	88 Å²	88	80 Å²	80	38%	0.383	39%	0.387	S	S	.	.	H	α-helix	trans	-69.9	-40.4	-176.9	-76.4	-174.5	170.8	-167.6	0	113.3	L105 F106 E147 S151	L105-K109 HydrophobicContact CD1-CD 4.49Å; L105-K109 HydrophobicContact CD1-CG 4.37Å; L105-K109 HydrophobicContact CG-CD 4.16Å; L105-K109 HydrophobicContact CG-CG 4.36Å; L105-K109 WeakPolarHBondContact O-CB 3.48Å; L105-K109 WeakPolarHBondContact O-CG 3.26Å; L105-K109 PolarHBondContact O-N 3.33Å; F106-K109 PolarHBondContact O-N 3.4Å; K109-E147 PolarHBondContact NZ-O 2.8Å; K109-S151 VanDerWaalsContact NZ-CB 3.32Å; K109-S151 PolarHBondContact NZ-OG 3.25Å
110	E	95.8	Very high	94.9	Very high	31 Å²	31	79.6 Å²	79.6	15%	0.145	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	21.8	-176.5	-65.3	-66.9	144.6	0	0	112.7	F106 N112 R113 I114 F120 I144	F106-E110 HydrophobicContact CD2-CG 4.49Å; F106-E110 HydrophobicContact CE2-CG 4.24Å; F106-E110 HydrophobicContact CZ-CG 4.41Å; F106-E110 WeakPolarHBondContact O-CB 3.42Å; F106-E110 PolarHBondContact O-N 3.21Å; E110-N112 PolarHBondContact O-N 2.87Å; E110-R113 PolarHBondContact O-N 3.16Å; E110-R113 VanDerWaalsContact OE2-CD 3.25Å; E110-R113 WeakPolarHBondContact OE2-CD 3.46Å; E110-R113 IonicContact OE2-CZ 3.96Å; E110-R113 IonicContact OE2-NE 3.21Å; E110-R113 IonicContact OE2-NH1 3.41Å; E110-R113 PolarHBondContact OE2-NH1 2.76Å; E110-I114 HydrophobicContact CB-CD1 4.43Å; E110-I114 WeakPolarHBondContact O-CG1 3.41Å; E110-I114 PolarHBondContact O-N 3.25Å; E110-F120 HydrophobicContact CB-CD2 4.22Å; E110-F120 HydrophobicContact CB-CE2 3.87Å; E110-F120 HydrophobicContact CG-CE2 4.03Å; E110-I144 HydrophobicContact CG-CG2 3.65Å
111	A	95	Very high	95.2	Very high	54 Å²	54	75.8 Å²	75.8	45%	0.446	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-50	-34.2	-179.9	0	0	0	0	0	113.2	M107 R113 I114	M107-A111 WeakPolarHBondContact O-CA 3.36Å; M107-A111 WeakPolarHBondContact O-CB 3.37Å; M107-A111 PolarHBondContact O-N 2.98Å; A111-R113 PolarHBondContact O-N 3.18Å; A111-I114 PolarHBondContact O-N 3.27Å
112	N	95.8	Very high	95.5	Very high	165 Å²	165	69.7 Å²	69.7	88%	0.882	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-67.1	-19.5	178.5	-65.1	-34	0	0	0	114.3	E110	E110-N112 PolarHBondContact O-N 2.87Å
113	R	95.4	Very high	95.6	Very high	113 Å²	113	71.9 Å²	71.9	43%	0.426	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-109.3	3.9	-179.1	-60.5	-168.8	-176.9	162.6	-0.1	113.1	E110 A111 F120 I121	E110-R113 PolarHBondContact O-N 3.16Å; E110-R113 VanDerWaalsContact OE2-CD 3.25Å; E110-R113 WeakPolarHBondContact OE2-CD 3.46Å; E110-R113 IonicContact OE2-CZ 3.96Å; E110-R113 IonicContact OE2-NE 3.21Å; E110-R113 IonicContact OE2-NH1 3.41Å; E110-R113 PolarHBondContact OE2-NH1 2.76Å; A111-R113 PolarHBondContact O-N 3.18Å; R113-F120 HydrophobicContact CB-CD2 4.03Å; R113-F120 HydrophobicContact CB-CE2 3.77Å; R113-I121 PolarHBondContact O-N 3.18Å; R113-I121 VanDerWaalsContact O-N 3.07Å
114	I	96.6	Very high	95.7	Very high	27 Å²	27	70.9 Å²	70.9	14%	0.138	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-106.5	127.1	-179.1	-65.3	170.9	0	0	0	108.8	V92 F106 M107 E110 A111 Y119 F120	V92-I114 HydrophobicContact CG2-CD1 4.41Å; F106-I114 HydrophobicContact CD1-CD1 4.35Å; F106-I114 HydrophobicContact CE1-CD1 4.25Å; M107-I114 HydrophobicContact CB-CD1 4.28Å; M107-I114 HydrophobicContact CG-CD1 4.13Å; E110-I114 HydrophobicContact CB-CD1 4.43Å; E110-I114 WeakPolarHBondContact O-CG1 3.41Å; E110-I114 PolarHBondContact O-N 3.25Å; A111-I114 PolarHBondContact O-N 3.27Å; I114-Y119 WeakPolarHBondContact CA-O 3.25Å; I114-F120 HydrophobicContact CG1-CB 4.18Å; I114-F120 HydrophobicContact CG1-CD2 3.97Å
115	N	95.7	Very high	95.8	Very high	76 Å²	76	67 Å²	67	41%	0.406	33%	0.329	S	S	.	.			trans	-75.1	167.5	175.9	-73.1	-2.4	0	0	0	111.4	E117 N118 Y119 I121	N115-E117 PolarHBondContact O-N 3.16Å; N115-N118 PolarHBondContact O-N 3.5Å; N115-Y119 PolarHBondContact N-O 3.3Å; N115-I121 WeakPolarHBondContact ND2-CD1 3.3Å
116	K	94.9	Very high	95.7	Very high	213 Å²	213	72.1 Å²	72.1	93%	0.926	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.1	176.6	-63.7	-177.8	179.3	-179.7	0	114.2	N118	K116-N118 VanDerWaalsContact C-N 3.27Å
117	E	95.4	Very high	95.5	Very high	139 Å²	139	74.6 Å²	74.6	65%	0.65	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	14.2	177.1	-66.1	176.1	-177.7	0	0	112.8	H91 N115 Y119	H91-E117 PolarHBondContact CD2-O 3.35Å; H91-E117 PolarHBondContact NE2-O 2.7Å; N115-E117 PolarHBondContact O-N 3.16Å; E117-Y119 HydrophobicContact CB-CD2 3.69Å; E117-Y119 HydrophobicContact CB-CE2 4.02Å; E117-Y119 WeakPolarHBondContact O-CD2 3.47Å; E117-Y119 PolarHBondContact O-N 3.41Å
118	N	95.7	Very high	95.2	Very high	58 Å²	58	80.8 Å²	80.8	31%	0.31	39%	0.387	S	S	.	.	S	Bend	trans	61.2	26.1	-179	-55.7	-40.2	0	0	0	115.4	V92 P93 N115 K116	V92-N118 PolarHBondContact N-O 2.8Å; P93-N118 HydrophobicContact CG-CB 3.79Å; N115-N118 PolarHBondContact O-N 3.5Å; K116-N118 VanDerWaalsContact C-N 3.27Å
119	Y	97.1	Very high	95.1	Very high	61 Å²	61	79.9 Å²	79.9	24%	0.239	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123	169.1	-75.6	-84.2	0	0	0	110.6	R89 F90 H91 I114 N115 E117	R89-Y119 HydrophobicContact CG-CD1 3.64Å; R89-Y119 HydrophobicContact CG-CG 4.12Å; F90-Y119 WeakPolarHBondContact O-CA 3.23Å; H91-Y119 HydrophobicContact CB-CD1 4.04Å; H91-Y119 HydrophobicContact CB-CE1 3.72Å; I114-Y119 WeakPolarHBondContact CA-O 3.25Å; N115-Y119 PolarHBondContact N-O 3.3Å; E117-Y119 HydrophobicContact CB-CD2 3.69Å; E117-Y119 HydrophobicContact CB-CE2 4.02Å; E117-Y119 WeakPolarHBondContact O-CD2 3.47Å; E117-Y119 PolarHBondContact O-N 3.41Å
120	F	97.6	Very high	95	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	134.5	169.2	176.3	-99.3	0	0	0	109.7	R89 F90 V92 F106 E110 R113 I114 I122 I141 I144	R89-F120 VanDerWaalsContact CA-O 3.27Å; R89-F120 WeakPolarHBondContact CA-O 3.46Å; F90-F120 HydrophobicContact CD1-CD1 4.26Å; F90-F120 HydrophobicContact CE1-CB 4.18Å; F90-F120 AromaticContact CE1-CD1 3.49Å; F90-F120 HydrophobicContact CE1-CD1 3.49Å; F90-F120 VanDerWaalsContact CE1-CD1 3.49Å; F90-F120 HydrophobicContact CE1-CE1 4.28Å; F90-F120 HydrophobicContact CE1-CG 4.21Å; F90-F120 HydrophobicContact CZ-CB 4.11Å; F90-F120 AromaticContact CZ-CD1 3.94Å; F90-F120 HydrophobicContact CZ-CD1 3.94Å; F90-F120 HydrophobicContact CZ-CG 4.29Å; F90-F120 PolarHBondContact N-O 3.09Å; F90-F120 PolarHBondContact O-N 3.24Å; V92-F120 HydrophobicContact CG2-CB 3.63Å; F106-F120 HydrophobicContact CE1-CB 4.11Å; F106-F120 AromaticContact CE1-CD2 3.72Å; F106-F120 HydrophobicContact CE1-CD2 3.72Å; F106-F120 HydrophobicContact CE1-CE2 4.27Å; F106-F120 AromaticContact CE1-CG 3.91Å; F106-F120 HydrophobicContact CE1-CG 3.91Å; F106-F120 HydrophobicContact CZ-CB 4.37Å; F106-F120 HydrophobicContact CZ-CD1 4.07Å; F106-F120 AromaticContact CZ-CD2 3.54Å; F106-F120 HydrophobicContact CZ-CD2 3.54Å; F106-F120 HydrophobicContact CZ-CE1 4.18Å; F106-F120 AromaticContact CZ-CE2 3.68Å; F106-F120 HydrophobicContact CZ-CE2 3.68Å; F106-F120 AromaticContact CZ-CG 3.73Å; F106-F120 HydrophobicContact CZ-CG 3.73Å; F106-F120 AromaticContact CZ-CZ 4Å; F106-F120 HydrophobicContact CZ-CZ 4Å; E110-F120 HydrophobicContact CB-CD2 4.22Å; E110-F120 HydrophobicContact CB-CE2 3.87Å; E110-F120 HydrophobicContact CG-CE2 4.03Å; R113-F120 HydrophobicContact CB-CD2 4.03Å; R113-F120 HydrophobicContact CB-CE2 3.77Å; I114-F120 HydrophobicContact CG1-CB 4.18Å; I114-F120 HydrophobicContact CG1-CD2 3.97Å; F120-I122 HydrophobicContact CE1-CB 3.8Å; F120-I122 HydrophobicContact CE1-CG2 4.04Å; F120-I122 HydrophobicContact CZ-CB 4.23Å; F120-I141 HydrophobicContact CE1-CG1 4.12Å; F120-I144 HydrophobicContact CZ-CD1 4.06Å
121	I	97.4	Very high	95	Very high	33 Å²	33	84.5 Å²	84.5	17%	0.169	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.5	-178.4	-57.5	177.1	0	0	0	109.9	E87 R89 R113 N115	E87-I121 HydrophobicContact CG-CG2 3.8Å; R89-I121 HydrophobicContact CB-CG1 4.41Å; R89-I121 HydrophobicContact CG-CG1 4.06Å; R113-I121 PolarHBondContact O-N 3.18Å; R113-I121 VanDerWaalsContact O-N 3.07Å; N115-I121 WeakPolarHBondContact ND2-CD1 3.3Å
122	I	97.1	Very high	95.1	Very high	5 Å²	5	86.2 Å²	86.2	3%	0.026	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	139.8	172.9	-167.9	166	0	0	0	110.9	E87 I88 F120 C137 R140 I141	E87-I122 WeakPolarHBondContact CA-O 3.37Å; I88-I122 HydrophobicContact CB-CG2 3.93Å; I88-I122 PolarHBondContact N-O 3.31Å; I88-I122 PolarHBondContact O-N 3.14Å; F120-I122 HydrophobicContact CE1-CB 3.8Å; F120-I122 HydrophobicContact CE1-CG2 4.04Å; F120-I122 HydrophobicContact CZ-CB 4.23Å; I122-C137 HydrophobicContact CG2-CB 4.18Å; I122-R140 HydrophobicContact CD1-CB 3.52Å; I122-I141 HydrophobicContact CD1-CG1 4.49Å; I122-I141 HydrophobicContact CG2-CD1 3.88Å; I122-I141 HydrophobicContact CG2-CG1 4Å
123	T	97	Very high	95.2	Very high	52 Å²	52	78.4 Å²	78.4	32%	0.319	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.2	-179.3	62.6	0	0	0	0	112.1	V86 E87 R140	V86-T123 CarbonylContact O-C 3.53Å; V86-T123 WeakPolarHBondContact O-CA 3.45Å; E87-T123 HydrophobicContact CB-CG2 3.8Å; E87-T123 HydrophobicContact CG-CG2 3.85Å; T123-R140 VanDerWaalsContact O-CZ 3.3Å; T123-R140 PolarHBondContact O-NH1 3.48Å; T123-R140 PolarHBondContact O-NH2 3.29Å
124	S	96.5	Very high	95.2	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.007	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	132.4	173.1	-163.8	0	0	0	0	111.2	K85 V86 H126 N133 D136 C137 R140	K85-S124 WeakPolarHBondContact CA-O 3.32Å; V86-S124 PolarHBondContact N-O 3.14Å; V86-S124 PolarHBondContact O-N 3.1Å; S124-H126 PolarHBondContact OG-CD2 3.36Å; S124-N133 VanDerWaalsContact CB-O 3.28Å; S124-N133 WeakPolarHBondContact CB-O 3.23Å; S124-D136 VanDerWaalsContact CB-OD2 3.3Å; S124-D136 WeakPolarHBondContact CB-OD2 3.47Å; S124-D136 PolarHBondContact OG-OD2 2.93Å; S124-C137 WeakPolarHBondContact CB-SG 3.48Å; S124-C137 PolarHBondContact N-SG 3.06Å; S124-R140 PolarHBondContact OG-NH2 3.47Å
125	D	94.2	Very high	95.3	Very high	57 Å²	57	76 Å²	76	31%	0.305	37%	0.367	S	S	.	.			trans	-137.8	27.8	170.4	61.1	-13.7	0	0	0	112.7	S72 K85 T127	S72-D125 PolarHBondContact OG-OD2 3.11Å; K85-D125 HydrophobicContact CB-CB 3.89Å; K85-D125 HydrophobicContact CD-CB 4.31Å; K85-D125 HydrophobicContact CG-CB 3.97Å; D125-T127 VanDerWaalsContact C-N 3.31Å; D125-T127 PolarHBondContact O-N 3.23Å
126	H	91.8	Very high	95.4	Very high	139 Å²	139	74.7 Å²	74.7	64%	0.644	36%	0.361	S	S	*	.	S	Bend	trans	-63.4	-31.7	-176.6	-70.5	-60.2	0	0	0	114.4	S124 D136	S124-H126 PolarHBondContact OG-CD2 3.36Å; H126-D136 IonicContact CD2-OD2 3.58Å; H126-D136 PolarHBondContact CD2-OD2 3.37Å; H126-D136 IonicContact NE2-OD2 3.48Å
127	T	91.4	Very high	95.5	Very high	51 Å²	51	64.6 Å²	64.6	31%	0.313	32%	0.316	S	S	.	.	S	Bend	trans	-126.8	161.9	-174.3	78.1	0	0	0	0	112.4	D125 K129 L132 N133	D125-T127 VanDerWaalsContact C-N 3.31Å; D125-T127 PolarHBondContact O-N 3.23Å; T127-K129 PolarHBondContact O-N 3.14Å; T127-K129 PolarHBondContact OG1-N 2.76Å; T127-K129 PolarHBondContact OG1-O 2.9Å; T127-K129 VanDerWaalsContact OG1-O 3.12Å; T127-L132 HydrophobicContact CG2-CB 4.26Å; T127-L132 HydrophobicContact CG2-CD1 4.25Å; T127-L132 WeakPolarHBondContact OG1-CB 3.47Å; T127-N133 WeakPolarHBondContact CB-OD1 3.12Å; T127-N133 PolarHBondContact N-OD1 3.31Å; T127-N133 PolarHBondContact O-ND2 2.96Å; T127-N133 PolarHBondContact OG1-OD1 2.91Å
128	R	89.6	Confident	95.6	Very high	192 Å²	192	58.9 Å²	58.9	73%	0.725	29%	0.29	S	S	*	.	S	Bend	trans	-69.2	-4.4	171	63	177.4	179.2	179.5	-0.2	114.8	H78 T84	H78-R128 WeakPolarHBondContact NE2-CB 3.36Å; T84-R128 VanDerWaalsContact CG2-O 3.25Å; T84-R128 WeakPolarHBondContact CG2-O 3.18Å
129	K	92.7	Very high	95.7	Very high	122 Å²	122	60.3 Å²	60.3	53%	0.53	30%	0.295	S	S	.	.			trans	-113.2	120	-174.6	-66	-173.1	179.1	-179.5	0	110.1	T127 I131 L132 N133	T127-K129 PolarHBondContact O-N 3.14Å; T127-K129 PolarHBondContact OG1-N 2.76Å; T127-K129 PolarHBondContact OG1-O 2.9Å; T127-K129 VanDerWaalsContact OG1-O 3.12Å; K129-I131 VanDerWaalsContact C-N 3.28Å; K129-I131 PolarHBondContact O-N 3.46Å; K129-L132 HydrophobicContact CB-CB 4.28Å; K129-L132 HydrophobicContact CB-CD1 4.05Å; K129-L132 HydrophobicContact CB-CG 4.01Å; K129-L132 HydrophobicContact CD-CD1 3.92Å; K129-L132 HydrophobicContact CD-CG 4.32Å; K129-L132 HydrophobicContact CG-CD1 4.4Å; K129-L132 PolarHBondContact O-N 3.27Å; K129-N133 PolarHBondContact O-N 3.25Å
130	Q	93.2	Very high	95.7	Very high	96 Å²	96	59.1 Å²	59.1	45%	0.449	29%	0.29	S	S	.	.	H	α-helix	trans	-56.4	-39.6	179.3	71.5	-170.9	7	0	0	113.1	Y68 V86 L132 N133 Q134	Y68-Q130 HydrophobicContact CD1-CB 4.22Å; Y68-Q130 HydrophobicContact CE1-CB 4Å; Y68-Q130 HydrophobicContact CE1-CG 4.43Å; V86-Q130 WeakPolarHBondContact CG2-O 3.16Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; Q130-L132 PolarHBondContact O-N 2.86Å; Q130-N133 PolarHBondContact O-N 3.18Å; Q130-Q134 WeakPolarHBondContact O-CB 3.25Å; Q130-Q134 PolarHBondContact O-N 3.47Å
131	I	96	Very high	95.7	Very high	121 Å²	121	59.1 Å²	59.1	62%	0.621	29%	0.29	S	S	*	.	H	α-helix	trans	-63.7	-40.5	-178	-62.2	170.8	0	0	0	111	K129 Q134 A135	K129-I131 VanDerWaalsContact C-N 3.28Å; K129-I131 PolarHBondContact O-N 3.46Å; I131-Q134 PolarHBondContact O-N 2.87Å; I131-A135 WeakPolarHBondContact O-CB 3.21Å; I131-A135 PolarHBondContact O-N 3.34Å
132	L	96.6	Very high	95.6	Very high	90 Å²	90	60.4 Å²	60.4	47%	0.471	29%	0.293	S	S	.	.	H	α-helix	trans	-69.5	-39.5	178.7	-65.4	-177.7	0	0	0	111.1	T127 K129 Q130 Q134 A135 D136	T127-L132 HydrophobicContact CG2-CB 4.26Å; T127-L132 HydrophobicContact CG2-CD1 4.25Å; T127-L132 WeakPolarHBondContact OG1-CB 3.47Å; K129-L132 HydrophobicContact CB-CB 4.28Å; K129-L132 HydrophobicContact CB-CD1 4.05Å; K129-L132 HydrophobicContact CB-CG 4.01Å; K129-L132 HydrophobicContact CD-CD1 3.92Å; K129-L132 HydrophobicContact CD-CG 4.32Å; K129-L132 HydrophobicContact CG-CD1 4.4Å; K129-L132 PolarHBondContact O-N 3.27Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; Q130-L132 PolarHBondContact O-N 2.86Å; L132-Q134 VanDerWaalsContact C-N 3.34Å; L132-A135 PolarHBondContact O-N 3.44Å; L132-D136 WeakPolarHBondContact O-CB 3.28Å; L132-D136 PolarHBondContact O-N 3.2Å
133	N	96.6	Very high	95.6	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-66.9	-36.8	176.6	-66.3	-11.1	0	0	0	111.6	T84 V86 S124 T127 K129 Q130 D136 C137	T84-N133 PolarHBondContact O-ND2 3Å; V86-N133 HydrophobicContact CB-CB 4.26Å; V86-N133 HydrophobicContact CG2-CB 3.72Å; S124-N133 VanDerWaalsContact CB-O 3.28Å; S124-N133 WeakPolarHBondContact CB-O 3.23Å; T127-N133 WeakPolarHBondContact CB-OD1 3.12Å; T127-N133 PolarHBondContact N-OD1 3.31Å; T127-N133 PolarHBondContact O-ND2 2.96Å; T127-N133 PolarHBondContact OG1-OD1 2.91Å; K129-N133 PolarHBondContact O-N 3.25Å; Q130-N133 PolarHBondContact O-N 3.18Å; N133-D136 PolarHBondContact O-N 3.41Å; N133-C137 PolarHBondContact O-N 3.25Å
134	Q	97.2	Very high	95.6	Very high	37 Å²	37	64.3 Å²	64.3	17%	0.173	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-46.2	173.1	-174.3	-176.4	-1.6	0	0	111.5	I66 V86 I88 Q130 I131 L132 D136 C137 L138	I66-Q134 HydrophobicContact CD1-CG 4.43Å; V86-Q134 HydrophobicContact CG1-CB 4.19Å; V86-Q134 HydrophobicContact CG1-CG 4.49Å; V86-Q134 HydrophobicContact CG2-CB 4.34Å; I88-Q134 HydrophobicContact CD1-CG 4.38Å; Q130-Q134 WeakPolarHBondContact O-CB 3.25Å; Q130-Q134 PolarHBondContact O-N 3.47Å; I131-Q134 PolarHBondContact O-N 2.87Å; L132-Q134 VanDerWaalsContact C-N 3.34Å; Q134-D136 VanDerWaalsContact C-N 3.29Å; Q134-D136 PolarHBondContact O-N 2.84Å; Q134-C137 PolarHBondContact O-N 3.33Å; Q134-L138 HydrophobicContact CG-CD1 4.47Å; Q134-L138 WeakPolarHBondContact O-CG 3.41Å; Q134-L138 PolarHBondContact O-N 3.01Å
135	A	97.4	Very high	95.5	Very high	52 Å²	52	64.2 Å²	64.2	43%	0.43	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-41	176.3	0	0	0	0	0	111.8	I131 L132 L138 E139	I131-A135 WeakPolarHBondContact O-CB 3.21Å; I131-A135 PolarHBondContact O-N 3.34Å; L132-A135 PolarHBondContact O-N 3.44Å; A135-L138 PolarHBondContact O-N 3.26Å; A135-E139 WeakPolarHBondContact O-CB 3.44Å; A135-E139 PolarHBondContact O-N 3.4Å
136	D	97.8	Very high	95.6	Very high	49 Å²	49	67.2 Å²	67.2	26%	0.262	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-43.5	175.4	170.5	69.8	0	0	0	112.6	S124 H126 L132 N133 Q134 L138 E139 R140	S124-D136 VanDerWaalsContact CB-OD2 3.3Å; S124-D136 WeakPolarHBondContact CB-OD2 3.47Å; S124-D136 PolarHBondContact OG-OD2 2.93Å; H126-D136 IonicContact CD2-OD2 3.58Å; H126-D136 PolarHBondContact CD2-OD2 3.37Å; H126-D136 IonicContact NE2-OD2 3.48Å; L132-D136 WeakPolarHBondContact O-CB 3.28Å; L132-D136 PolarHBondContact O-N 3.2Å; N133-D136 PolarHBondContact O-N 3.41Å; Q134-D136 VanDerWaalsContact C-N 3.29Å; Q134-D136 PolarHBondContact O-N 2.84Å; D136-L138 PolarHBondContact O-N 2.96Å; D136-E139 PolarHBondContact O-N 3Å; D136-R140 WeakPolarHBondContact O-CB 3.4Å; D136-R140 WeakPolarHBondContact O-CG 3.44Å; D136-R140 PolarHBondContact O-N 3.23Å; D136-R140 IonicContact OD1-NE 3.81Å; D136-R140 IonicContact OD2-CZ 3.88Å; D136-R140 IonicContact OD2-NE 3.32Å; D136-R140 PolarHBondContact OD2-NE 2.95Å; D136-R140 IonicContact OD2-NH2 3.89Å; D136-R140 PolarHBondContact OD2-NH2 3.48Å
137	C	97.7	Very high	95.7	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.1	-47.8	172.6	-77.1	0	0	0	0	111.6	I88 I122 S124 N133 Q134 E139 R140 I141	I88-C137 HydrophobicContact CB-CB 4.49Å; I88-C137 HydrophobicContact CD1-CB 3.44Å; I88-C137 VanDerWaalsContact CD1-CB 3.44Å; I88-C137 HydrophobicContact CG1-CB 3.84Å; I122-C137 HydrophobicContact CG2-CB 4.18Å; S124-C137 WeakPolarHBondContact CB-SG 3.48Å; S124-C137 PolarHBondContact N-SG 3.06Å; N133-C137 PolarHBondContact O-N 3.25Å; Q134-C137 PolarHBondContact O-N 3.33Å; C137-E139 VanDerWaalsContact C-N 3.34Å; C137-E139 PolarHBondContact O-N 3.37Å; C137-R140 PolarHBondContact O-N 3.42Å; C137-I141 WeakPolarHBondContact O-CG1 3.41Å; C137-I141 PolarHBondContact O-N 3.35Å
138	L	97.4	Very high	95.9	Very high	19 Å²	19	62.6 Å²	62.6	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-41.5	179.5	-69.6	173.5	0	0	0	111.9	I59 L64 I88 Q134 A135 D136 I141 R142	I59-L138 HydrophobicContact CD1-CD2 4.5Å; I59-L138 HydrophobicContact CG2-CD2 4.49Å; L64-L138 HydrophobicContact CD1-CD2 3.57Å; I88-L138 HydrophobicContact CD1-CD2 3.89Å; I88-L138 HydrophobicContact CD1-CG 3.97Å; Q134-L138 HydrophobicContact CG-CD1 4.47Å; Q134-L138 WeakPolarHBondContact O-CG 3.41Å; Q134-L138 PolarHBondContact O-N 3.01Å; A135-L138 PolarHBondContact O-N 3.26Å; D136-L138 PolarHBondContact O-N 2.96Å; L138-I141 WeakPolarHBondContact O-CB 3.46Å; L138-I141 PolarHBondContact O-N 3.47Å; L138-R142 WeakPolarHBondContact O-CG 3.41Å; L138-R142 PolarHBondContact O-N 3.3Å
139	E	97.2	Very high	96	Very high	89 Å²	89	55.1 Å²	55.1	42%	0.416	26%	0.26	S	S	.	.	H	α-helix	trans	-68	-38.3	179.1	-170.4	55	-154.9	0	0	112.1	A135 D136 C137 I141 R142 R143 R146	A135-E139 WeakPolarHBondContact O-CB 3.44Å; A135-E139 PolarHBondContact O-N 3.4Å; D136-E139 PolarHBondContact O-N 3Å; C137-E139 VanDerWaalsContact C-N 3.34Å; C137-E139 PolarHBondContact O-N 3.37Å; E139-I141 VanDerWaalsContact C-N 3.34Å; E139-I141 PolarHBondContact O-N 2.98Å; E139-R142 PolarHBondContact O-N 2.92Å; E139-R142 IonicContact OE2-NH1 2.98Å; E139-R142 PolarHBondContact OE2-NH1 3.43Å; E139-R143 WeakPolarHBondContact O-CB 3.48Å; E139-R143 PolarHBondContact O-N 3.33Å; E139-R146 IonicContact OE1-NH1 3.6Å
140	R	97.3	Very high	96	Very high	36 Å²	36	54.4 Å²	54.4	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-40.7	172.6	-74.8	-172.6	-77.9	147	-1.1	112.1	I122 T123 S124 D136 C137 R143 I144	I122-R140 HydrophobicContact CD1-CB 3.52Å; T123-R140 VanDerWaalsContact O-CZ 3.3Å; T123-R140 PolarHBondContact O-NH1 3.48Å; T123-R140 PolarHBondContact O-NH2 3.29Å; S124-R140 PolarHBondContact OG-NH2 3.47Å; D136-R140 WeakPolarHBondContact O-CB 3.4Å; D136-R140 WeakPolarHBondContact O-CG 3.44Å; D136-R140 PolarHBondContact O-N 3.23Å; D136-R140 IonicContact OD1-NE 3.81Å; D136-R140 IonicContact OD2-CZ 3.88Å; D136-R140 IonicContact OD2-NE 3.32Å; D136-R140 PolarHBondContact OD2-NE 2.95Å; D136-R140 IonicContact OD2-NH2 3.89Å; D136-R140 PolarHBondContact OD2-NH2 3.48Å; C137-R140 PolarHBondContact O-N 3.42Å; R140-R143 PolarHBondContact O-N 2.89Å; R140-I144 VanDerWaalsContact O-CG1 3.26Å; R140-I144 WeakPolarHBondContact O-CG1 3.47Å; R140-I144 PolarHBondContact O-N 3Å
141	I	97	Very high	95.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-49.5	173.1	-67.9	164.5	0	0	0	110.1	I59 I88 F90 W97 F120 I122 C137 L138 E139 R143 I144 I145	I59-I141 HydrophobicContact CD1-CB 4.2Å; I59-I141 HydrophobicContact CD1-CG2 3.76Å; I88-I141 HydrophobicContact CB-CD1 4.48Å; I88-I141 HydrophobicContact CG2-CD1 3.95Å; F90-I141 HydrophobicContact CE1-CD1 4.22Å; F90-I141 HydrophobicContact CE1-CG2 4.38Å; W97-I141 HydrophobicContact CH2-CG2 4.01Å; F120-I141 HydrophobicContact CE1-CG1 4.12Å; I122-I141 HydrophobicContact CD1-CG1 4.49Å; I122-I141 HydrophobicContact CG2-CD1 3.88Å; I122-I141 HydrophobicContact CG2-CG1 4Å; C137-I141 WeakPolarHBondContact O-CG1 3.41Å; C137-I141 PolarHBondContact O-N 3.35Å; L138-I141 WeakPolarHBondContact O-CB 3.46Å; L138-I141 PolarHBondContact O-N 3.47Å; E139-I141 VanDerWaalsContact C-N 3.34Å; E139-I141 PolarHBondContact O-N 2.98Å; I141-R143 VanDerWaalsContact C-N 3.31Å; I141-R143 PolarHBondContact O-N 3.09Å; I141-I144 PolarHBondContact O-N 3.32Å; I141-I145 HydrophobicContact CG2-CD1 3.73Å; I141-I145 HydrophobicContact CG2-CG1 4.5Å; I141-I145 WeakPolarHBondContact O-CG1 3.32Å; I141-I145 PolarHBondContact O-N 3Å
142	R	96.6	Very high	95.6	Very high	59 Å²	59	50.3 Å²	50.3	22%	0.223	25%	0.247	C	C	.	.	H	α-helix	trans	-57.2	-44.7	177.3	-69.5	-173.3	-171.4	92.9	9.1	112.2	F55 G57 I59 L138 E139 I145 R146	F55-R142 HydrophobicContact CZ-CG 4.39Å; G57-R142 PolarHBondContact O-NE 2.89Å; I59-R142 HydrophobicContact CD1-CG 3.65Å; I59-R142 HydrophobicContact CG1-CG 4.43Å; L138-R142 WeakPolarHBondContact O-CG 3.41Å; L138-R142 PolarHBondContact O-N 3.3Å; E139-R142 PolarHBondContact O-N 2.92Å; E139-R142 IonicContact OE2-NH1 2.98Å; E139-R142 PolarHBondContact OE2-NH1 3.43Å; R142-I145 PolarHBondContact O-N 3.41Å; R142-R146 WeakPolarHBondContact O-CB 3.34Å; R142-R146 VanDerWaalsContact O-CG 3.31Å; R142-R146 WeakPolarHBondContact O-CG 3.5Å; R142-R146 PolarHBondContact O-N 3.43Å
143	R	96.9	Very high	95.1	Very high	132 Å²	132	51.8 Å²	51.8	50%	0.498	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-49	180	-175.3	176.9	66.5	-152.5	0.1	111.6	E139 R140 I141 I145 R146 E147	E139-R143 WeakPolarHBondContact O-CB 3.48Å; E139-R143 PolarHBondContact O-N 3.33Å; R140-R143 PolarHBondContact O-N 2.89Å; I141-R143 VanDerWaalsContact C-N 3.31Å; I141-R143 PolarHBondContact O-N 3.09Å; R143-I145 VanDerWaalsContact C-N 3.31Å; R143-I145 PolarHBondContact O-N 3.2Å; R143-R146 PolarHBondContact O-N 2.9Å; R143-E147 HydrophobicContact CG-CG 4.47Å; R143-E147 WeakPolarHBondContact CG-OE1 3.13Å; R143-E147 IonicContact NE-OE1 2.71Å; R143-E147 WeakPolarHBondContact O-CG 3.37Å; R143-E147 PolarHBondContact O-N 3.37Å
144	I	96.3	Very high	94.7	Very high	7 Å²	7	59.3 Å²	59.3	4%	0.036	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-43.5	179.7	-65.8	164.7	0	0	0	110.7	F106 E110 F120 R140 I141 R146 E147 C148	F106-I144 HydrophobicContact CD2-CG2 3.73Å; F106-I144 HydrophobicContact CE2-CB 4.29Å; F106-I144 HydrophobicContact CE2-CG2 3.45Å; F106-I144 VanDerWaalsContact CE2-CG2 3.45Å; E110-I144 HydrophobicContact CG-CG2 3.65Å; F120-I144 HydrophobicContact CZ-CD1 4.06Å; R140-I144 VanDerWaalsContact O-CG1 3.26Å; R140-I144 WeakPolarHBondContact O-CG1 3.47Å; R140-I144 PolarHBondContact O-N 3Å; I141-I144 PolarHBondContact O-N 3.32Å; I144-R146 PolarHBondContact O-N 2.97Å; I144-E147 PolarHBondContact O-N 2.94Å; I144-C148 PolarHBondContact O-N 3.43Å; I144-C148 PolarHBondContact O-SG 3.25Å
145	I	95.4	Very high	94.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-42.3	178.7	-65	171.4	0	0	0	110.8	F55 W97 I98 V102 F106 I141 R142 R143 C148 V149	F55-I145 HydrophobicContact CB-CG2 4.11Å; F55-I145 HydrophobicContact CD1-CB 4.13Å; F55-I145 HydrophobicContact CD1-CG2 3.39Å; F55-I145 HydrophobicContact CD2-CG2 4Å; F55-I145 HydrophobicContact CE1-CB 3.95Å; F55-I145 HydrophobicContact CE1-CD1 4.47Å; F55-I145 HydrophobicContact CE1-CG2 3.67Å; F55-I145 HydrophobicContact CE2-CD1 4.3Å; F55-I145 HydrophobicContact CE2-CG2 4.28Å; F55-I145 HydrophobicContact CG-CG2 3.55Å; F55-I145 HydrophobicContact CZ-CB 4.37Å; F55-I145 HydrophobicContact CZ-CD1 4.05Å; F55-I145 HydrophobicContact CZ-CG2 4.11Å; W97-I145 HydrophobicContact CE3-CD1 4.44Å; W97-I145 HydrophobicContact CH2-CD1 3.69Å; W97-I145 HydrophobicContact CZ3-CD1 3.32Å; I98-I145 HydrophobicContact CD1-CD1 4.08Å; I98-I145 HydrophobicContact CG1-CD1 4.24Å; V102-I145 HydrophobicContact CG1-CG2 4Å; F106-I145 HydrophobicContact CD2-CG1 4.19Å; F106-I145 HydrophobicContact CE2-CG1 4.15Å; I141-I145 HydrophobicContact CG2-CD1 3.73Å; I141-I145 HydrophobicContact CG2-CG1 4.5Å; I141-I145 WeakPolarHBondContact O-CG1 3.32Å; I141-I145 PolarHBondContact O-N 3Å; R142-I145 PolarHBondContact O-N 3.41Å; R143-I145 VanDerWaalsContact C-N 3.31Å; R143-I145 PolarHBondContact O-N 3.2Å; I145-C148 WeakPolarHBondContact O-CB 3.4Å; I145-C148 PolarHBondContact O-N 2.95Å; I145-V149 WeakPolarHBondContact O-CG2 3.39Å; I145-V149 PolarHBondContact O-N 2.97Å
146	R	95	Very high	93.6	Very high	120 Å²	120	68.6 Å²	68.6	45%	0.453	33%	0.332	S	S	.	.	H	α-helix	trans	-61	-44.5	173.8	-73.7	172.8	178.9	161	0.1	112	F55 E139 R142 R143 I144 C148 V149 D150	F55-R146 HydrophobicContact CD1-CG 4.49Å; E139-R146 IonicContact OE1-NH1 3.6Å; R142-R146 WeakPolarHBondContact O-CB 3.34Å; R142-R146 VanDerWaalsContact O-CG 3.31Å; R142-R146 WeakPolarHBondContact O-CG 3.5Å; R142-R146 PolarHBondContact O-N 3.43Å; R143-R146 PolarHBondContact O-N 2.9Å; I144-R146 PolarHBondContact O-N 2.97Å; R146-C148 PolarHBondContact O-N 3.24Å; R146-V149 WeakPolarHBondContact O-CB 3.31Å; R146-V149 PolarHBondContact O-N 3.06Å; R146-V149 VanDerWaalsContact O-N 3.1Å; R146-D150 WeakPolarHBondContact O-CB 3.44Å; R146-D150 VanDerWaalsContact O-CG 3.22Å; R146-D150 PolarHBondContact O-N 3.05Å
147	E	95	Very high	93.2	Very high	92 Å²	92	69 Å²	69	43%	0.43	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-31	175.4	-72.4	171.2	-168.9	0	0	112.6	K109 R143 I144 S151	K109-E147 PolarHBondContact NZ-O 2.8Å; R143-E147 HydrophobicContact CG-CG 4.47Å; R143-E147 WeakPolarHBondContact CG-OE1 3.13Å; R143-E147 IonicContact NE-OE1 2.71Å; R143-E147 WeakPolarHBondContact O-CG 3.37Å; R143-E147 PolarHBondContact O-N 3.37Å; I144-E147 PolarHBondContact O-N 2.94Å; E147-S151 WeakPolarHBondContact O-CB 3.48Å; E147-S151 PolarHBondContact O-N 3.33Å; E147-S151 VanDerWaalsContact O-N 3.16Å; E147-S151 PolarHBondContact O-OG 3.4Å
148	C	94.4	Very high	92.9	Very high	1 Å²	1	71.5 Å²	71.5	1%	0.007	36%	0.355	C	S	.	.	H	α-helix	trans	-69.2	-48.9	171.4	-64	0	0	0	0	111.1	V102 L105 I144 I145 R146 D150 S151 L152	V102-C148 HydrophobicContact CG1-CB 3.74Å; L105-C148 HydrophobicContact CD2-CB 4.09Å; L105-C148 VanDerWaalsContact CD2-O 3.25Å; L105-C148 WeakPolarHBondContact CD2-O 3.25Å; L105-C148 HydrophobicContact CG-CB 4.49Å; I144-C148 PolarHBondContact O-N 3.43Å; I144-C148 PolarHBondContact O-SG 3.25Å; I145-C148 WeakPolarHBondContact O-CB 3.4Å; I145-C148 PolarHBondContact O-N 2.95Å; R146-C148 PolarHBondContact O-N 3.24Å; C148-D150 VanDerWaalsContact C-N 3.33Å; C148-D150 PolarHBondContact O-N 2.87Å; C148-S151 PolarHBondContact O-N 3.07Å; C148-S151 VanDerWaalsContact O-N 3.14Å; C148-L152 PolarHBondContact O-N 2.95Å
149	V	93.1	Very high	92.7	Very high	35 Å²	35	75.1 Å²	75.1	21%	0.212	38%	0.38	C	S	.	.	H	α-helix	trans	-56.2	-47.2	175.2	173.3	0	0	0	0	111.3	F55 V102 I145 R146 S151 L152 N153	F55-V149 HydrophobicContact CB-CG2 4.37Å; V102-V149 HydrophobicContact CG1-CG2 4.24Å; V102-V149 HydrophobicContact CG2-CG2 3.59Å; I145-V149 WeakPolarHBondContact O-CG2 3.39Å; I145-V149 PolarHBondContact O-N 2.97Å; R146-V149 WeakPolarHBondContact O-CB 3.31Å; R146-V149 PolarHBondContact O-N 3.06Å; R146-V149 VanDerWaalsContact O-N 3.1Å; V149-S151 PolarHBondContact O-N 2.84Å; V149-L152 PolarHBondContact O-N 2.87Å; V149-N153 PolarHBondContact O-N 2.78Å; V149-N153 VanDerWaalsContact O-N 3.09Å; V149-N153 PolarHBondContact O-ND2 2.92Å
150	D	92.2	Very high	92.5	Very high	106 Å²	106	78.2 Å²	78.2	57%	0.567	39%	0.394	S	S	*	.	H	α-helix	trans	-63.2	-33.4	179.8	-67.8	-19.7	0	0	0	112.1	R146 C148 N153 K154	R146-D150 WeakPolarHBondContact O-CB 3.44Å; R146-D150 VanDerWaalsContact O-CG 3.22Å; R146-D150 PolarHBondContact O-N 3.05Å; C148-D150 VanDerWaalsContact C-N 3.33Å; C148-D150 PolarHBondContact O-N 2.87Å; D150-N153 PolarHBondContact O-N 2.84Å; D150-K154 PolarHBondContact O-N 2.98Å; D150-K154 VanDerWaalsContact O-N 3.11Å
151	S	90.6	Very high	92.3	Very high	53 Å²	53	79.6 Å²	79.6	37%	0.371	41%	0.407	S	S	.	.	H	α-helix	trans	-74.4	-31.9	177.6	-63	0	0	0	0	112.9	K109 E147 C148 V149 N153	K109-S151 VanDerWaalsContact NZ-CB 3.32Å; K109-S151 PolarHBondContact NZ-OG 3.25Å; E147-S151 WeakPolarHBondContact O-CB 3.48Å; E147-S151 PolarHBondContact O-N 3.33Å; E147-S151 VanDerWaalsContact O-N 3.16Å; E147-S151 PolarHBondContact O-OG 3.4Å; C148-S151 PolarHBondContact O-N 3.07Å; C148-S151 VanDerWaalsContact O-N 3.14Å; V149-S151 PolarHBondContact O-N 2.84Å; S151-N153 VanDerWaalsContact C-N 3.34Å
152	L	89.5	Confident	92.1	Very high	78 Å²	78	83.4 Å²	83.4	41%	0.408	43%	0.427	S	S	.	.	H	α-helix	trans	-68	-36.8	172	-68.9	173	0	0	0	111.7	Q101 V102 L105 C148 V149 K154	Q101-L152 HydrophobicContact CB-CD1 4.05Å; V102-L152 HydrophobicContact CB-CD1 4.49Å; V102-L152 HydrophobicContact CG2-CD1 3.76Å; L105-L152 HydrophobicContact CB-CD2 4.45Å; L105-L152 HydrophobicContact CD2-CD2 3.9Å; L105-L152 HydrophobicContact CD2-CG 3.76Å; C148-L152 PolarHBondContact O-N 2.95Å; V149-L152 PolarHBondContact O-N 2.87Å; L152-K154 VanDerWaalsContact C-N 3.31Å
153	N	87.7	Confident	92	Very high	122 Å²	122	86.2 Å²	86.2	65%	0.652	44%	0.443	S	S	*	.	S	Bend	trans	-85.2	-2.8	-179.2	-66.7	-35.5	0	0	0	113.6	V149 D150 S151	V149-N153 PolarHBondContact O-N 2.78Å; V149-N153 VanDerWaalsContact O-N 3.09Å; V149-N153 PolarHBondContact O-ND2 2.92Å; D150-N153 PolarHBondContact O-N 2.84Å; S151-N153 VanDerWaalsContact C-N 3.34Å
154	K	87.8	Confident	91.9	Very high	158 Å²	158	81.7 Å²	81.7	69%	0.687	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-69.1	125.9	-175.3	-169	173.6	-175.1	178.1	0	109.6	D150 L152	D150-K154 PolarHBondContact O-N 2.98Å; D150-K154 VanDerWaalsContact O-N 3.11Å; L152-K154 VanDerWaalsContact C-N 3.31Å
155	P	86.1	Confident	91.8	Very high	107 Å²	107	84.4 Å²	84.4	70%	0.695	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-64.9	143.4	176.2	26.9	-33.8	0	0	0	110.4
156	E	85.6	Confident	91.9	Very high	177 Å²	177	90.3 Å²	90.3	83%	0.827	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-55.2	135.8	167.9	-71.1	-72.3	169.4	0	0	109.5
157	P	88.5	Confident	91.9	Very high	57 Å²	57	93.5 Å²	93.5	37%	0.37	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-62.9	139.3	178.6	26.8	-34.3	0	0	0	110.8	T161 L162	P157-T161 HydrophobicContact CB-CG2 4.31Å; P157-L162 HydrophobicContact CB-CD2 4.09Å; P157-L162 HydrophobicContact CB-CG 4.11Å; P157-L162 HydrophobicContact CG-CD1 4.24Å; P157-L162 HydrophobicContact CG-CD2 3.51Å; P157-L162 HydrophobicContact CG-CG 3.83Å
158	S	91.9	Very high	92	Very high	54 Å²	54	97.7 Å²	97.7	38%	0.378	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-59.5	151.3	175.2	73.8	0	0	0	0	111	E160 T161 L162	S158-E160 VanDerWaalsContact C-N 3.25Å; S158-E160 PolarHBondContact O-N 3.27Å; S158-T161 WeakPolarHBondContact O-CA 3.43Å; S158-T161 VanDerWaalsContact O-CB 3.3Å; S158-T161 WeakPolarHBondContact O-CB 3.34Å; S158-T161 PolarHBondContact O-N 2.95Å; S158-T161 WeakPolarHBondContact OG-CB 3.15Å; S158-T161 PolarHBondContact OG-N 3.34Å; S158-T161 PolarHBondContact OG-OG1 3.33Å; S158-L162 PolarHBondContact O-N 3.35Å
159	P	92.5	Very high	92.1	Very high	95 Å²	95	104.7 Å²	104.7	62%	0.617	53%	0.529	S	S	*	.	H	α-helix	trans	-56.3	-40.5	179.6	21.4	-33.2	0	0	0	112.1	T161 L162 E163	P159-T161 VanDerWaalsContact C-N 3.29Å; P159-T161 PolarHBondContact O-N 3.38Å; P159-L162 WeakPolarHBondContact O-CB 3.34Å; P159-L162 PolarHBondContact O-N 2.95Å; P159-L162 VanDerWaalsContact O-N 3.14Å; P159-E163 WeakPolarHBondContact O-CG 3.32Å; P159-E163 PolarHBondContact O-N 3.28Å
160	E	93.7	Very high	92.3	Very high	153 Å²	153	109.3 Å²	109.3	72%	0.715	55%	0.55	S	S	*	*	H	α-helix	trans	-59.7	-39	174.4	-61.9	-177	173	0	0	112.5	S158 E163 A164	S158-E160 VanDerWaalsContact C-N 3.25Å; S158-E160 PolarHBondContact O-N 3.27Å; E160-E163 PolarHBondContact O-N 3.24Å; E160-A164 WeakPolarHBondContact O-CB 3.45Å; E160-A164 PolarHBondContact O-N 3.39Å
161	T	92	Very high	92.5	Very high	66 Å²	66	111.3 Å²	111.3	41%	0.405	55%	0.554	S	S	.	*	H	α-helix	trans	-66	-42.3	176.4	-58.4	0	0	0	0	110.6	P157 S158 P159 A164 I165	P157-T161 HydrophobicContact CB-CG2 4.31Å; S158-T161 WeakPolarHBondContact O-CA 3.43Å; S158-T161 VanDerWaalsContact O-CB 3.3Å; S158-T161 WeakPolarHBondContact O-CB 3.34Å; S158-T161 PolarHBondContact O-N 2.95Å; S158-T161 WeakPolarHBondContact OG-CB 3.15Å; S158-T161 PolarHBondContact OG-N 3.34Å; S158-T161 PolarHBondContact OG-OG1 3.33Å; P159-T161 VanDerWaalsContact C-N 3.29Å; P159-T161 PolarHBondContact O-N 3.38Å; T161-A164 PolarHBondContact O-N 3.01Å; T161-I165 HydrophobicContact CG2-CD1 4Å; T161-I165 WeakPolarHBondContact O-CD1 3.24Å; T161-I165 VanDerWaalsContact O-CG1 3.23Å; T161-I165 WeakPolarHBondContact O-CG1 3.41Å; T161-I165 PolarHBondContact O-N 3.38Å
162	L	93.4	Very high	92.8	Very high	80 Å²	80	111.6 Å²	111.6	42%	0.419	56%	0.559	S	S	.	*	H	α-helix	trans	-61.9	-45.5	176	-71.7	174.5	0	0	0	111.6	P157 S158 P159 I165 Q166	P157-L162 HydrophobicContact CB-CD2 4.09Å; P157-L162 HydrophobicContact CB-CG 4.11Å; P157-L162 HydrophobicContact CG-CD1 4.24Å; P157-L162 HydrophobicContact CG-CD2 3.51Å; P157-L162 HydrophobicContact CG-CG 3.83Å; S158-L162 PolarHBondContact O-N 3.35Å; P159-L162 WeakPolarHBondContact O-CB 3.34Å; P159-L162 PolarHBondContact O-N 2.95Å; P159-L162 VanDerWaalsContact O-N 3.14Å; L162-I165 PolarHBondContact O-N 3.21Å; L162-Q166 WeakPolarHBondContact O-CG 3.45Å; L162-Q166 PolarHBondContact O-N 2.99Å
163	E	94.7	Very high	93.2	Very high	117 Å²	117	110.9 Å²	110.9	55%	0.547	56%	0.556	S	S	.	*	H	α-helix	trans	-61.7	-43.7	175.9	-72.8	-176.9	-172.7	0	0	112.2	P159 E160 I165 Q166 R167	P159-E163 WeakPolarHBondContact O-CG 3.32Å; P159-E163 PolarHBondContact O-N 3.28Å; E160-E163 PolarHBondContact O-N 3.24Å; E163-I165 VanDerWaalsContact C-N 3.32Å; E163-I165 PolarHBondContact O-N 2.68Å; E163-Q166 PolarHBondContact O-N 2.98Å; E163-R167 WeakPolarHBondContact O-CB 3.47Å; E163-R167 PolarHBondContact O-N 3.11Å
164	A	95.1	Very high	93.7	Very high	37 Å²	37	111.8 Å²	111.8	31%	0.306	56%	0.556	S	S	.	*	H	α-helix	trans	-61.6	-40.7	176.4	0	0	0	0	0	111.8	E160 T161 R167 R168	E160-A164 WeakPolarHBondContact O-CB 3.45Å; E160-A164 PolarHBondContact O-N 3.39Å; T161-A164 PolarHBondContact O-N 3.01Å; A164-R167 PolarHBondContact O-N 2.96Å; A164-R168 VanDerWaalsContact O-CG 3.29Å; A164-R168 WeakPolarHBondContact O-CG 3.47Å; A164-R168 PolarHBondContact O-N 3.38Å
165	I	94.6	Very high	94.2	Very high	64 Å²	64	108.5 Å²	108.5	33%	0.328	54%	0.543	S	S	.	.	H	α-helix	trans	-62.8	-45.3	174.5	-70.1	165.1	0	0	0	110.5	T161 L162 E163 R168 K169	T161-I165 HydrophobicContact CG2-CD1 4Å; T161-I165 WeakPolarHBondContact O-CD1 3.24Å; T161-I165 VanDerWaalsContact O-CG1 3.23Å; T161-I165 WeakPolarHBondContact O-CG1 3.41Å; T161-I165 PolarHBondContact O-N 3.38Å; L162-I165 PolarHBondContact O-N 3.21Å; E163-I165 VanDerWaalsContact C-N 3.32Å; E163-I165 PolarHBondContact O-N 2.68Å; I165-R168 PolarHBondContact O-N 2.89Å; I165-K169 HydrophobicContact CG2-CD 4.37Å; I165-K169 WeakPolarHBondContact O-CG 3.46Å; I165-K169 PolarHBondContact O-N 3.12Å
166	Q	95.9	Very high	94.7	Very high	125 Å²	125	111.1 Å²	111.1	58%	0.584	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-46.4	177.6	-72.1	178	4.1	0	0	111.7	L162 E163 R168 K169 M170	L162-Q166 WeakPolarHBondContact O-CG 3.45Å; L162-Q166 PolarHBondContact O-N 2.99Å; E163-Q166 PolarHBondContact O-N 2.98Å; Q166-R168 VanDerWaalsContact C-N 3.32Å; Q166-R168 PolarHBondContact O-N 3.44Å; Q166-K169 PolarHBondContact O-N 2.97Å; Q166-K169 VanDerWaalsContact O-N 3.17Å; Q166-M170 WeakPolarHBondContact O-CG 3.27Å; Q166-M170 PolarHBondContact O-N 3.15Å
167	R	96.2	Very high	95.2	Very high	187 Å²	187	106.3 Å²	106.3	71%	0.706	52%	0.519	S	S	*	.	H	α-helix	trans	-58.5	-42.6	177	-168.9	-176.2	-62.3	-179.5	1.8	111.9	E163 A164 M170 K171	E163-R167 WeakPolarHBondContact O-CB 3.47Å; E163-R167 PolarHBondContact O-N 3.11Å; A164-R167 PolarHBondContact O-N 2.96Å; R167-M170 PolarHBondContact O-N 2.89Å; R167-K171 WeakPolarHBondContact O-CB 3.35Å; R167-K171 PolarHBondContact O-N 2.79Å
168	R	96.5	Very high	95.7	Very high	179 Å²	179	110.2 Å²	110.2	68%	0.675	53%	0.526	S	S	*	.	H	α-helix	trans	-63.2	-44.3	175.5	-72.7	174.1	-170.4	161.2	4.6	112	A164 I165 Q166 M170 K171 A172	A164-R168 VanDerWaalsContact O-CG 3.29Å; A164-R168 WeakPolarHBondContact O-CG 3.47Å; A164-R168 PolarHBondContact O-N 3.38Å; I165-R168 PolarHBondContact O-N 2.89Å; Q166-R168 VanDerWaalsContact C-N 3.32Å; Q166-R168 PolarHBondContact O-N 3.44Å; R168-M170 VanDerWaalsContact C-N 3.35Å; R168-M170 PolarHBondContact O-N 2.85Å; R168-K171 PolarHBondContact O-N 3.26Å; R168-A172 WeakPolarHBondContact O-CB 3.31Å; R168-A172 PolarHBondContact O-N 3.22Å
169	K	96.6	Very high	95.9	Very high	148 Å²	148	111.6 Å²	111.6	64%	0.643	53%	0.527	S	S	*	.	H	α-helix	trans	-61.4	-42.2	176.3	-74.8	-179.4	177.8	-178.7	0	111.9	I165 Q166 N173	I165-K169 HydrophobicContact CG2-CD 4.37Å; I165-K169 WeakPolarHBondContact O-CG 3.46Å; I165-K169 PolarHBondContact O-N 3.12Å; Q166-K169 PolarHBondContact O-N 2.97Å; Q166-K169 VanDerWaalsContact O-N 3.17Å; K169-N173 WeakPolarHBondContact O-CB 3.3Å; K169-N173 PolarHBondContact O-N 3.02Å
170	M	96.6	Very high	96.1	Very high	133 Å²	133	114.3 Å²	114.3	66%	0.655	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-49.6	177.1	-71.4	-64.8	-72	0	0	111.6	Q166 R167 R168 A172 N173 E174	Q166-M170 WeakPolarHBondContact O-CG 3.27Å; Q166-M170 PolarHBondContact O-N 3.15Å; R167-M170 PolarHBondContact O-N 2.89Å; R168-M170 VanDerWaalsContact C-N 3.35Å; R168-M170 PolarHBondContact O-N 2.85Å; M170-A172 PolarHBondContact O-N 3.44Å; M170-N173 PolarHBondContact O-N 3.33Å; M170-E174 PolarHBondContact O-N 3.38Å
171	K	97.4	Very high	96.3	Very high	148 Å²	148	114.5 Å²	114.5	64%	0.643	53%	0.527	S	S	*	.	H	α-helix	trans	-58.4	-45.8	177.2	-173.8	-179.9	178.8	-177.4	0	112.1	R167 R168 N173 E174 E175	R167-K171 WeakPolarHBondContact O-CB 3.35Å; R167-K171 PolarHBondContact O-N 2.79Å; R168-K171 PolarHBondContact O-N 3.26Å; K171-N173 VanDerWaalsContact C-N 3.32Å; K171-N173 PolarHBondContact O-N 3Å; K171-E174 PolarHBondContact O-N 3.33Å; K171-E175 WeakPolarHBondContact O-CB 3.12Å; K171-E175 PolarHBondContact O-N 3.42Å
172	A	97.4	Very high	96.5	Very high	58 Å²	58	116.4 Å²	116.4	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-37	177.8	0	0	0	0	0	112.4	R168 M170 R176	R168-A172 WeakPolarHBondContact O-CB 3.31Å; R168-A172 PolarHBondContact O-N 3.22Å; M170-A172 PolarHBondContact O-N 3.44Å; A172-R176 WeakPolarHBondContact O-CB 3.46Å; A172-R176 PolarHBondContact O-N 3.19Å
173	N	97.6	Very high	96.6	Very high	63 Å²	63	118.8 Å²	118.8	34%	0.337	54%	0.538	S	S	.	.	H	α-helix	trans	-69	-40.8	175.9	-175.5	36.1	0	0	0	112.3	K169 M170 K171 R176 L177	K169-N173 WeakPolarHBondContact O-CB 3.3Å; K169-N173 PolarHBondContact O-N 3.02Å; M170-N173 PolarHBondContact O-N 3.33Å; K171-N173 VanDerWaalsContact C-N 3.32Å; K171-N173 PolarHBondContact O-N 3Å; N173-R176 PolarHBondContact O-N 3.06Å; N173-R176 PolarHBondContact OD1-NE 3.41Å; N173-R176 PolarHBondContact OD1-NH2 3.04Å; N173-L177 WeakPolarHBondContact O-CB 3.47Å; N173-L177 WeakPolarHBondContact O-CG 3.4Å; N173-L177 PolarHBondContact O-N 2.82Å
174	E	97.5	Very high	96.6	Very high	141 Å²	141	115.9 Å²	115.9	66%	0.659	53%	0.531	S	S	*	.	H	α-helix	trans	-61.3	-47	175.9	-174.5	-178.2	179.7	0	0	111.5	M170 K171 L177 R178	M170-E174 PolarHBondContact O-N 3.38Å; K171-E174 PolarHBondContact O-N 3.33Å; E174-L177 PolarHBondContact O-N 3.47Å; E174-R178 PolarHBondContact O-N 3.4Å
175	E	97.4	Very high	96.5	Very high	90 Å²	90	120.7 Å²	120.7	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-60.6	-47	176.7	-175.9	162.7	-143.9	0	0	111.7	K171 L177 R178 E179	K171-E175 WeakPolarHBondContact O-CB 3.12Å; K171-E175 PolarHBondContact O-N 3.42Å; E175-L177 VanDerWaalsContact C-N 3.29Å; E175-L177 PolarHBondContact O-N 3.32Å; E175-R178 WeakPolarHBondContact O-CB 3.45Å; E175-R178 PolarHBondContact O-N 3.22Å; E175-R178 VanDerWaalsContact O-N 3.14Å; E175-R178 IonicContact OE1-NH2 3.71Å; E175-E179 PolarHBondContact O-N 3.18Å
176	R	97.2	Very high	96.4	Very high	161 Å²	161	120.7 Å²	120.7	61%	0.608	55%	0.545	S	S	*	.	H	α-helix	trans	-56.2	-42.2	173.4	-177	-169.1	69.1	152.8	-0.2	112.3	A172 N173 K180	A172-R176 WeakPolarHBondContact O-CB 3.46Å; A172-R176 PolarHBondContact O-N 3.19Å; N173-R176 PolarHBondContact O-N 3.06Å; N173-R176 PolarHBondContact OD1-NE 3.41Å; N173-R176 PolarHBondContact OD1-NH2 3.04Å; R176-K180 WeakPolarHBondContact O-CB 3.48Å; R176-K180 PolarHBondContact O-N 3.23Å
177	L	97.3	Very high	96.2	Very high	77 Å²	77	121.7 Å²	121.7	40%	0.403	55%	0.548	S	S	.	.	H	α-helix	trans	-68.4	-39.2	178.2	-76.4	169.8	0	0	0	111.7	N173 E174 E175 K180 K181	N173-L177 WeakPolarHBondContact O-CB 3.47Å; N173-L177 WeakPolarHBondContact O-CG 3.4Å; N173-L177 PolarHBondContact O-N 2.82Å; E174-L177 PolarHBondContact O-N 3.47Å; E175-L177 VanDerWaalsContact C-N 3.29Å; E175-L177 PolarHBondContact O-N 3.32Å; L177-K180 PolarHBondContact O-N 2.91Å; L177-K181 WeakPolarHBondContact O-CG 3.19Å; L177-K181 PolarHBondContact O-N 3.13Å
178	R	97.2	Very high	96	Very high	138 Å²	138	118.3 Å²	118.3	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-60.6	-51.4	174.8	-170.8	-176.4	70	-158.5	-6.5	110.9	E174 E175 K180 K181 E182	E174-R178 PolarHBondContact O-N 3.4Å; E175-R178 WeakPolarHBondContact O-CB 3.45Å; E175-R178 PolarHBondContact O-N 3.22Å; E175-R178 VanDerWaalsContact O-N 3.14Å; E175-R178 IonicContact OE1-NH2 3.71Å; R178-K180 VanDerWaalsContact C-N 3.29Å; R178-K180 PolarHBondContact O-N 3.02Å; R178-K181 WeakPolarHBondContact O-CB 3.49Å; R178-K181 PolarHBondContact O-N 2.99Å; R178-K181 VanDerWaalsContact O-N 3.08Å; R178-E182 IonicContact NE-OE1 3.69Å; R178-E182 WeakPolarHBondContact O-CG 3.44Å; R178-E182 PolarHBondContact O-N 3.46Å
179	E	97.4	Very high	95.6	Very high	83 Å²	83	115.2 Å²	115.2	39%	0.388	53%	0.532	S	S	.	.	H	α-helix	trans	-58.4	-40.6	176.6	-71.5	-177.6	-168.7	0	0	112.4	E175 K181 E182 K183	E175-E179 PolarHBondContact O-N 3.18Å; E179-K181 VanDerWaalsContact C-N 3.34Å; E179-K181 PolarHBondContact O-N 2.91Å; E179-E182 PolarHBondContact O-N 3.17Å; E179-K183 WeakPolarHBondContact O-CB 3.33Å; E179-K183 WeakPolarHBondContact O-CG 3.48Å; E179-K183 PolarHBondContact O-N 3.2Å
180	K	97.2	Very high	95	Very high	152 Å²	152	116.6 Å²	116.6	66%	0.661	53%	0.533	S	S	*	.	H	α-helix	trans	-62.5	-41.7	176.5	-174.7	178.9	178.2	-177.7	0	111.3	R176 L177 R178 S184	R176-K180 WeakPolarHBondContact O-CB 3.48Å; R176-K180 PolarHBondContact O-N 3.23Å; L177-K180 PolarHBondContact O-N 2.91Å; R178-K180 VanDerWaalsContact C-N 3.29Å; R178-K180 PolarHBondContact O-N 3.02Å; K180-S184 WeakPolarHBondContact O-CB 3.41Å; K180-S184 PolarHBondContact O-N 2.78Å
181	K	96.9	Very high	94.2	Very high	158 Å²	158	116.4 Å²	116.4	69%	0.687	53%	0.53	S	S	*	.	H	α-helix	trans	-64.9	-46.2	176.3	-74	177.7	179	-177.2	0	111.4	L177 R178 E179 K183 S184 Y185	L177-K181 WeakPolarHBondContact O-CG 3.19Å; L177-K181 PolarHBondContact O-N 3.13Å; R178-K181 WeakPolarHBondContact O-CB 3.49Å; R178-K181 PolarHBondContact O-N 2.99Å; R178-K181 VanDerWaalsContact O-N 3.08Å; E179-K181 VanDerWaalsContact C-N 3.34Å; E179-K181 PolarHBondContact O-N 2.91Å; K181-K183 PolarHBondContact O-N 3.27Å; K181-S184 WeakPolarHBondContact O-CB 3.48Å; K181-S184 PolarHBondContact O-N 3.44Å; K181-S184 VanDerWaalsContact O-N 3.13Å; K181-Y185 PolarHBondContact O-N 3.46Å
182	E	96.2	Very high	93.3	Very high	106 Å²	106	114 Å²	114	50%	0.495	52%	0.524	S	S	.	.	H	α-helix	trans	-59.2	-45.1	176.8	-71.4	170	-174.9	0	0	112.1	R178 E179 S184 Y185 T186	R178-E182 IonicContact NE-OE1 3.69Å; R178-E182 WeakPolarHBondContact O-CG 3.44Å; R178-E182 PolarHBondContact O-N 3.46Å; E179-E182 PolarHBondContact O-N 3.17Å; E182-S184 VanDerWaalsContact C-N 3.34Å; E182-S184 PolarHBondContact O-N 3.35Å; E182-Y185 PolarHBondContact O-N 3.48Å; E182-T186 WeakPolarHBondContact O-CB 3.4Å; E182-T186 PolarHBondContact O-N 3.12Å; E182-T186 PolarHBondContact O-OG1 3.35Å
183	K	95.1	Very high	91.7	Very high	129 Å²	129	117.6 Å²	117.6	56%	0.561	53%	0.531	S	S	*	.	H	α-helix	trans	-62.9	-39.6	174	-73.9	174.4	-177.7	167.1	0	112.1	E179 K181 K187	E179-K183 WeakPolarHBondContact O-CB 3.33Å; E179-K183 WeakPolarHBondContact O-CG 3.48Å; E179-K183 PolarHBondContact O-N 3.2Å; K181-K183 PolarHBondContact O-N 3.27Å; K183-K187 WeakPolarHBondContact O-CG 3.45Å; K183-K187 PolarHBondContact O-N 3.23Å; K183-K187 VanDerWaalsContact O-N 3.07Å
184	S	95.3	Very high	89.9	Confident	56 Å²	56	119.8 Å²	119.8	39%	0.392	54%	0.543	S	S	.	.	H	α-helix	trans	-63.1	-47.3	176.4	-170.7	0	0	0	0	111.5	K180 K181 E182 K187 Q188	K180-S184 WeakPolarHBondContact O-CB 3.41Å; K180-S184 PolarHBondContact O-N 2.78Å; K181-S184 WeakPolarHBondContact O-CB 3.48Å; K181-S184 PolarHBondContact O-N 3.44Å; K181-S184 VanDerWaalsContact O-N 3.13Å; E182-S184 VanDerWaalsContact C-N 3.34Å; E182-S184 PolarHBondContact O-N 3.35Å; S184-K187 PolarHBondContact O-N 2.98Å; S184-Q188 WeakPolarHBondContact O-CG 2.87Å; S184-Q188 PolarHBondContact O-N 3.38Å
185	Y	93.7	Very high	88.1	Confident	138 Å²	138	117.7 Å²	117.7	54%	0.541	54%	0.535	S	S	.	.	H	α-helix	trans	-59.5	-48.6	177.4	-173.9	-97.3	0	0	0	110.7	K181 E182 K187 Q188 F189	K181-Y185 PolarHBondContact O-N 3.46Å; E182-Y185 PolarHBondContact O-N 3.48Å; Y185-K187 VanDerWaalsContact C-N 3.27Å; Y185-K187 PolarHBondContact O-N 3.24Å; Y185-Q188 WeakPolarHBondContact O-CB 3.11Å; Y185-Q188 PolarHBondContact O-N 3.49Å; Y185-F189 AromaticContact CD1-CD2 3.76Å; Y185-F189 HydrophobicContact CD1-CD2 3.76Å; Y185-F189 AromaticContact CD1-CE2 3.86Å; Y185-F189 HydrophobicContact CD1-CE2 3.86Å; Y185-F189 HydrophobicContact CD2-CD2 4.21Å; Y185-F189 AromaticContact CD2-CE2 3.78Å; Y185-F189 HydrophobicContact CD2-CE2 3.78Å; Y185-F189 AromaticContact CE1-CD2 3.56Å; Y185-F189 HydrophobicContact CE1-CD2 3.56Å; Y185-F189 AromaticContact CE1-CE2 3.28Å; Y185-F189 HydrophobicContact CE1-CE2 3.28Å; Y185-F189 HydrophobicContact CE1-CG 4.43Å; Y185-F189 AromaticContact CE1-CZ 3.89Å; Y185-F189 HydrophobicContact CE1-CZ 3.89Å; Y185-F189 HydrophobicContact CE2-CD2 4.06Å; Y185-F189 AromaticContact CE2-CE2 3.22Å; Y185-F189 HydrophobicContact CE2-CE2 3.22Å; Y185-F189 AromaticContact CE2-CZ 3.97Å; Y185-F189 HydrophobicContact CE2-CZ 3.97Å; Y185-F189 HydrophobicContact CG-CD2 4.09Å; Y185-F189 HydrophobicContact CG-CE2 4.08Å; Y185-F189 AromaticContact CZ-CD2 3.73Å; Y185-F189 AromaticContact CZ-CE2 2.94Å; Y185-F189 AromaticContact CZ-CZ 3.39Å; Y185-F189 WeakPolarHBondContact O-CD2 3.24Å; Y185-F189 PolarHBondContact O-N 2.96Å; Y185-F189 WeakPolarHBondContact OH-CE2 3.4Å; Y185-F189 WeakPolarHBondContact OH-CZ 3.31Å
186	T	92.2	Very high	86.3	Confident	64 Å²	64	117.7 Å²	117.7	39%	0.393	54%	0.542	S	S	.	.	H	α-helix	trans	-56.3	-40.2	176.4	-55.1	0	0	0	0	112.3	E182 R190	E182-T186 WeakPolarHBondContact O-CB 3.4Å; E182-T186 PolarHBondContact O-N 3.12Å; E182-T186 PolarHBondContact O-OG1 3.35Å; T186-R190 VanDerWaalsContact O-CG 3.29Å; T186-R190 WeakPolarHBondContact O-CG 3.19Å; T186-R190 PolarHBondContact O-N 2.61Å
187	K	91.8	Very high	84.3	Confident	146 Å²	146	116.2 Å²	116.2	64%	0.635	55%	0.546	S	S	*	.	H	α-helix	trans	-68.5	-38.9	176.4	-74	177.2	-179.7	-171.4	0	112.7	K183 S184 Y185 R190 H191	K183-K187 WeakPolarHBondContact O-CG 3.45Å; K183-K187 PolarHBondContact O-N 3.23Å; K183-K187 VanDerWaalsContact O-N 3.07Å; S184-K187 PolarHBondContact O-N 2.98Å; Y185-K187 VanDerWaalsContact C-N 3.27Å; Y185-K187 PolarHBondContact O-N 3.24Å; K187-R190 PolarHBondContact O-N 2.85Å; K187-H191 PolarHBondContact O-N 2.88Å; K187-H191 VanDerWaalsContact O-N 3.12Å
188	Q	91.3	Very high	82.4	Confident	117 Å²	117	119 Å²	119	55%	0.547	56%	0.561	S	S	.	*	H	α-helix	trans	-61.6	-47.8	176.1	-73.6	171.2	-14.2	0	0	110.9	S184 Y185 R190 H191 D192	S184-Q188 WeakPolarHBondContact O-CG 2.87Å; S184-Q188 PolarHBondContact O-N 3.38Å; Y185-Q188 WeakPolarHBondContact O-CB 3.11Å; Y185-Q188 PolarHBondContact O-N 3.49Å; Q188-R190 VanDerWaalsContact C-N 3.3Å; Q188-R190 PolarHBondContact O-N 3.3Å; Q188-H191 WeakPolarHBondContact O-CB 3.12Å; Q188-H191 PolarHBondContact O-N 3.46Å; Q188-D192 PolarHBondContact O-N 3.08Å
189	F	87.9	Confident	80.2	Confident	114 Å²	114	125.4 Å²	125.4	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-61.1	-36.2	177	-86.3	-96.7	0	0	0	113.3	Y185 H191 H193	Y185-F189 AromaticContact CD1-CD2 3.76Å; Y185-F189 HydrophobicContact CD1-CD2 3.76Å; Y185-F189 AromaticContact CD1-CE2 3.86Å; Y185-F189 HydrophobicContact CD1-CE2 3.86Å; Y185-F189 HydrophobicContact CD2-CD2 4.21Å; Y185-F189 AromaticContact CD2-CE2 3.78Å; Y185-F189 HydrophobicContact CD2-CE2 3.78Å; Y185-F189 AromaticContact CE1-CD2 3.56Å; Y185-F189 HydrophobicContact CE1-CD2 3.56Å; Y185-F189 AromaticContact CE1-CE2 3.28Å; Y185-F189 HydrophobicContact CE1-CE2 3.28Å; Y185-F189 HydrophobicContact CE1-CG 4.43Å; Y185-F189 AromaticContact CE1-CZ 3.89Å; Y185-F189 HydrophobicContact CE1-CZ 3.89Å; Y185-F189 HydrophobicContact CE2-CD2 4.06Å; Y185-F189 AromaticContact CE2-CE2 3.22Å; Y185-F189 HydrophobicContact CE2-CE2 3.22Å; Y185-F189 AromaticContact CE2-CZ 3.97Å; Y185-F189 HydrophobicContact CE2-CZ 3.97Å; Y185-F189 HydrophobicContact CG-CD2 4.09Å; Y185-F189 HydrophobicContact CG-CE2 4.08Å; Y185-F189 AromaticContact CZ-CD2 3.73Å; Y185-F189 AromaticContact CZ-CE2 2.94Å; Y185-F189 AromaticContact CZ-CZ 3.39Å; Y185-F189 WeakPolarHBondContact O-CD2 3.24Å; Y185-F189 PolarHBondContact O-N 2.96Å; Y185-F189 WeakPolarHBondContact OH-CE2 3.4Å; Y185-F189 WeakPolarHBondContact OH-CZ 3.31Å; F189-H191 VanDerWaalsContact C-N 3.29Å; F189-H191 PolarHBondContact O-N 2.82Å; F189-H193 PolarHBondContact O-N 3.19Å
190	R	83.8	Confident	79.4	Confident	177 Å²	177	127.6 Å²	127.6	67%	0.668	60%	0.603	S	S	*	*	H	α-helix	trans	-67.2	-29.9	173.9	-71.2	172.5	-169.4	-173.4	3.1	113	T186 K187 Q188 N194	T186-R190 VanDerWaalsContact O-CG 3.29Å; T186-R190 WeakPolarHBondContact O-CG 3.19Å; T186-R190 PolarHBondContact O-N 2.61Å; K187-R190 PolarHBondContact O-N 2.85Å; Q188-R190 VanDerWaalsContact C-N 3.3Å; Q188-R190 PolarHBondContact O-N 3.3Å; R190-N194 PolarHBondContact O-ND2 3.28Å
191	H	80.9	Confident	78.5	Confident	128 Å²	128	126.3 Å²	126.3	59%	0.593	60%	0.6	S	S	*	*	H	α-helix	trans	-78.1	-43.1	178	-171.7	46.1	0	0	0	111	K187 Q188 F189 H193 N194	K187-H191 PolarHBondContact O-N 2.88Å; K187-H191 VanDerWaalsContact O-N 3.12Å; Q188-H191 WeakPolarHBondContact O-CB 3.12Å; Q188-H191 PolarHBondContact O-N 3.46Å; F189-H191 VanDerWaalsContact C-N 3.29Å; F189-H191 PolarHBondContact O-N 2.82Å; H191-H193 PolarHBondContact O-N 2.93Å; H191-N194 WeakPolarHBondContact O-CB 3.43Å; H191-N194 PolarHBondContact O-N 3.05Å; H191-N194 VanDerWaalsContact O-N 3.12Å; H191-N194 PolarHBondContact O-ND2 3.21Å
192	D	77.4	Confident	77.4	Confident	97 Å²	97	124.5 Å²	124.5	52%	0.519	60%	0.595	S	S	.	*	H	α-helix	trans	-66.5	-34.3	-174.4	-154.9	28.7	0	0	0	113.1	Q188 N194 L195	Q188-D192 PolarHBondContact O-N 3.08Å; D192-N194 PolarHBondContact O-N 3.1Å; D192-N194 VanDerWaalsContact O-N 3.11Å; D192-L195 PolarHBondContact O-N 3.27Å
193	H	64.7	Low	76.3	Confident	135 Å²	135	125.6 Å²	125.6	63%	0.625	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-19.4	174.6	-174.6	44.3	0	0	0	113.6	F189 H191 L195 T196	F189-H193 PolarHBondContact O-N 3.19Å; H191-H193 PolarHBondContact O-N 2.93Å; H193-L195 VanDerWaalsContact C-N 3.33Å; H193-T196 PolarHBondContact O-OG1 3.41Å
194	N	60.1	Low	75.1	Confident	109 Å²	109	125.4 Å²	125.4	58%	0.583	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-12	174.5	-58	-58	0	0	0	112.9	R190 H191 D192	R190-N194 PolarHBondContact O-ND2 3.28Å; H191-N194 WeakPolarHBondContact O-CB 3.43Å; H191-N194 PolarHBondContact O-N 3.05Å; H191-N194 VanDerWaalsContact O-N 3.12Å; H191-N194 PolarHBondContact O-ND2 3.21Å; D192-N194 PolarHBondContact O-N 3.1Å; D192-N194 VanDerWaalsContact O-N 3.11Å
195	L	58.4	Low	73.8	Confident	96 Å²	96	130 Å²	130	50%	0.503	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.6	-12.7	-179.4	-68.1	173.8	0	0	0	113	D192 H193 D197	D192-L195 PolarHBondContact O-N 3.27Å; H193-L195 VanDerWaalsContact C-N 3.33Å; L195-D197 VanDerWaalsContact C-N 3.34Å; L195-D197 PolarHBondContact O-N 3.48Å
196	T	59.8	Low	72.4	Confident	91 Å²	91	129.4 Å²	129.4	56%	0.558	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	1.6	-178.6	49.6	0	0	0	0	115.2	H193	H193-T196 PolarHBondContact O-OG1 3.41Å
197	D	55.7	Low	70.9	Confident	130 Å²	130	134.5 Å²	134.5	70%	0.695	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	23.7	176.4	-71.9	-14.3	0	0	0	113.2	L195	L195-D197 VanDerWaalsContact C-N 3.34Å; L195-D197 PolarHBondContact O-N 3.48Å
198	L	56.8	Low	69.1	Low	136 Å²	136	133.5 Å²	133.5	71%	0.712	64%	0.641	S	S	*	*			trans	-118.9	24.4	-174.7	-72.6	175.6	0	0	0	115.7
199	F	52.7	Low	67.1	Low	272 Å²	272	135 Å²	135	100%	1.193	65%	0.65	S	S	*	*			trans	-129.5	0	164.2	-72.1	-75.9	0	0	0	110.3

Retrieved 199 of 199 residues in 77.5 ms (Link to these results)

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