A0A5K4F9J2_SCHMA Loading...

IL4_i_Ig domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F9J2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 211 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	53.5	Low	56.2	Low	223 Å²	223	139.6 Å²	139.6	100%	1.099	71%	0.705	S	S	*	*				0	-26.1	0	-78	-179.1	72.1	0	0	114.4	V3	M1-V3 PolarHBondContact O-N 3.19Å
2	L	53.4	Low	56.2	Low	134 Å²	134	138.4 Å²	138.4	70%	0.702	71%	0.709	S	S	*	*	H	α-helix	trans	-66.9	-30.7	-178.8	-116.2	84.1	0	0	0	115.1	S4 L5 F6	L2-S4 VanDerWaalsContact C-N 3.31Å; L2-S4 PolarHBondContact O-N 3.21Å; L2-L5 PolarHBondContact O-N 3.11Å; L2-F6 WeakPolarHBondContact O-CD2 3.18Å
3	V	56.4	Low	55.7	Low	115 Å²	115	135.3 Å²	135.3	70%	0.697	71%	0.707	S	S	*	*	H	α-helix	trans	-68	-31.1	-174.2	-177.1	0	0	0	0	112.2	M1 L5	M1-V3 PolarHBondContact O-N 3.19Å; V3-L5 VanDerWaalsContact C-N 3.34Å; V3-L5 PolarHBondContact O-N 2.8Å
4	S	57.3	Low	55.2	Low	83 Å²	83	134.1 Å²	134.1	58%	0.58	71%	0.714	S	S	*	*	H	α-helix	trans	-73.3	-24.6	179.7	-54.7	0	0	0	0	113.2	L2	L2-S4 VanDerWaalsContact C-N 3.31Å; L2-S4 PolarHBondContact O-N 3.21Å
5	L	57.5	Low	54.8	Low	115 Å²	115	132.7 Å²	132.7	60%	0.602	72%	0.715	S	S	*	*	H	α-helix	trans	-73.5	-35.5	-179.4	-161.7	75.5	0	0	0	111.9	L2 V3 L7 L8	L2-L5 PolarHBondContact O-N 3.11Å; V3-L5 VanDerWaalsContact C-N 3.34Å; V3-L5 PolarHBondContact O-N 2.8Å; L5-L7 VanDerWaalsContact C-N 3.3Å; L5-L7 PolarHBondContact O-N 2.85Å; L5-L8 PolarHBondContact O-N 2.87Å
6	F	56.2	Low	54.6	Low	143 Å²	143	130.8 Å²	130.8	63%	0.627	71%	0.709	S	S	*	*	H	α-helix	trans	-68.8	-27.1	179.1	-76.2	-76.3	0	0	0	113.4	L2	L2-F6 WeakPolarHBondContact O-CD2 3.18Å
7	L	57.8	Low	54.2	Low	124 Å²	124	131 Å²	131	65%	0.649	72%	0.716	S	S	*	*	H	α-helix	trans	-73.8	-30.6	177.1	-82.1	159.8	0	0	0	112.7	L5	L5-L7 VanDerWaalsContact C-N 3.3Å; L5-L7 PolarHBondContact O-N 2.85Å
8	L	55.9	Low	53.6	Low	119 Å²	119	135 Å²	135	62%	0.623	72%	0.72	S	S	*	*	H	α-helix	trans	-73	-32.7	177.2	-91	148.9	0	0	0	112.8	L5 R10 L11	L5-L8 PolarHBondContact O-N 2.87Å; L8-R10 VanDerWaalsContact C-N 3.32Å; L8-R10 PolarHBondContact O-N 2.77Å; L8-L11 PolarHBondContact O-N 2.99Å
9	I	57.8	Low	53	Low	110 Å²	110	132.9 Å²	132.9	56%	0.564	72%	0.724	S	S	*	*	H	α-helix	trans	-71.8	-27	-178.8	-62.4	169.4	0	0	0	111.8	L11	I9-L11 VanDerWaalsContact C-N 3.26Å; I9-L11 PolarHBondContact O-N 3.46Å
10	R	55.7	Low	52.2	Low	225 Å²	225	134.9 Å²	134.9	85%	0.849	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-14.2	177.9	-78.3	-93.6	-171.6	173.8	0.3	114.2	L8	L8-R10 VanDerWaalsContact C-N 3.32Å; L8-R10 PolarHBondContact O-N 2.77Å
11	L	56.7	Low	51.5	Low	145 Å²	145	136.9 Å²	136.9	76%	0.759	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-7	-177.7	-80.7	157.9	0	0	0	114	L8 I9	L8-L11 PolarHBondContact O-N 2.99Å; I9-L11 VanDerWaalsContact C-N 3.26Å; I9-L11 PolarHBondContact O-N 3.46Å
12	V	55.9	Low	50.9	Low	125 Å²	125	131.1 Å²	131.1	76%	0.758	72%	0.719	S	S	*	*	S	Bend	trans	-115.9	62.5	-177.7	-170.4	0	0	0	0	110.2
13	S	50.5	Low	50.1	Low	98 Å²	98	132.5 Å²	132.5	69%	0.685	73%	0.727	S	S	*	*			trans	-147.4	59	169.3	-43.2	0	0	0	0	110	P15	S13-P15 WeakPolarHBondContact O-CD 3.3Å
14	C	48.6	Very low	49.3	Very low	119 Å²	119	134.2 Å²	134.2	80%	0.804	73%	0.727	S	S	*	*			trans	-80.8	107.8	161.7	-79.6	0	0	0	0	107.7	T16	C14-T16 PolarHBondContact O-N 3.15Å
15	P	49.5	Very low	48.1	Very low	113 Å²	113	141.8 Å²	141.8	73%	0.734	74%	0.743	S	S	*	*			trans	-68.7	108	170.4	28.1	-31.8	0	0	0	108.1	S13 V17	S13-P15 WeakPolarHBondContact O-CD 3.3Å; P15-V17 PolarHBondContact O-N 2.92Å
16	T	50.8	Low	47.2	Very low	101 Å²	101	141.7 Å²	141.7	62%	0.62	75%	0.747	S	S	*	*			trans	-62.1	104.3	165.2	45.6	0	0	0	0	108	C14 Y18	C14-T16 PolarHBondContact O-N 3.15Å; T16-Y18 WeakPolarHBondContact O-CD2 3.48Å; T16-Y18 PolarHBondContact O-N 2.93Å; T16-Y18 VanDerWaalsContact O-N 3.16Å
17	V	47.6	Very low	46.2	Very low	135 Å²	135	141.7 Å²	141.7	82%	0.818	76%	0.759	S	S	*	*			trans	-71.8	105	171.4	178.2	0	0	0	0	106.9	P15 A19	P15-V17 PolarHBondContact O-N 2.92Å; V17-A19 PolarHBondContact O-N 3.03Å
18	Y	43.2	Very low	45.2	Very low	203 Å²	203	142.1 Å²	142.1	80%	0.796	77%	0.767	S	S	*	*			trans	-69.3	109.1	169.2	-66.5	-84.9	0	0	0	108	T16 L20	T16-Y18 WeakPolarHBondContact O-CD2 3.48Å; T16-Y18 PolarHBondContact O-N 2.93Å; T16-Y18 VanDerWaalsContact O-N 3.16Å; Y18-L20 PolarHBondContact O-N 3.23Å
19	A	43.5	Very low	44.2	Very low	95 Å²	95	141.1 Å²	141.1	79%	0.785	78%	0.775	S	S	*	*			trans	-70.4	112.6	166.8	0	0	0	0	0	107.6	V17 E21	V17-A19 PolarHBondContact O-N 3.03Å; A19-E21 PolarHBondContact O-N 2.86Å; A19-E21 VanDerWaalsContact O-N 3.08Å
20	L	36.9	Very low	43	Very low	172 Å²	172	142.3 Å²	142.3	90%	0.901	78%	0.783	S	S	*	*			trans	-65.5	107.7	171.9	-161.6	81	0	0	0	107.4	Y18 S22	Y18-L20 PolarHBondContact O-N 3.23Å; L20-S22 PolarHBondContact O-N 3.39Å
21	E	36.9	Very low	42.1	Very low	178 Å²	178	139 Å²	139	83%	0.832	78%	0.782	S	S	*	*			trans	-61.1	99.7	178.2	-164.9	160.4	-167.1	0	0	108.9	A19 N23	A19-E21 PolarHBondContact O-N 2.86Å; A19-E21 VanDerWaalsContact O-N 3.08Å; E21-N23 PolarHBondContact O-N 2.82Å
22	S	40.8	Very low	41.1	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	79%	0.789	S	S	*	*			trans	-72.2	119.1	176.4	68	0	0	0	0	108.3	L20 H24	L20-S22 PolarHBondContact O-N 3.39Å; S22-H24 VanDerWaalsContact C-N 3.27Å; S22-H24 PolarHBondContact O-N 3.23Å
23	N	36.7	Very low	40	Very low	164 Å²	164	138 Å²	138	88%	0.877	78%	0.784	S	S	*	*			trans	-61.1	83.3	175	-72.3	-49.5	0	0	0	111.2	E21 R25	E21-N23 PolarHBondContact O-N 2.82Å; N23-R25 PolarHBondContact O-N 2.8Å; N23-R25 VanDerWaalsContact O-N 3.12Å
24	H	39.3	Very low	39.2	Very low	150 Å²	150	139.4 Å²	139.4	69%	0.694	79%	0.794	S	S	*	*			trans	-76.6	97.8	170.6	-162.8	-46.3	0	0	0	107.8	S22 T26	S22-H24 VanDerWaalsContact C-N 3.27Å; S22-H24 PolarHBondContact O-N 3.23Å; H24-T26 PolarHBondContact O-N 3.27Å
25	R	32.6	Very low	38.5	Very low	243 Å²	243	141.4 Å²	141.4	92%	0.917	79%	0.791	S	S	*	*			trans	-57	104.6	165.1	-104.1	-177	-172.1	160.9	3.4	107.8	N23	N23-R25 PolarHBondContact O-N 2.8Å; N23-R25 VanDerWaalsContact O-N 3.12Å
26	T	38.7	Very low	37.9	Very low	113 Å²	113	144.1 Å²	144.1	69%	0.693	80%	0.799	S	S	*	*			trans	-93.3	113.6	169.8	17.5	0	0	0	0	107	H24 V28	H24-T26 PolarHBondContact O-N 3.27Å; T26-V28 PolarHBondContact O-N 2.87Å
27	T	34.9	Very low	37.4	Very low	142 Å²	142	151 Å²	151	87%	0.871	81%	0.813	S	S	*	*			trans	-58.6	119.2	167.4	31.6	0	0	0	0	108.7	A29	T27-A29 PolarHBondContact O-N 2.98Å
28	V	37	Very low	36.9	Very low	134 Å²	134	149.7 Å²	149.7	81%	0.812	81%	0.81	S	S	*	*			trans	-67.6	97.4	-176.5	-177.1	0	0	0	0	109	T26 N30	T26-V28 PolarHBondContact O-N 2.87Å; V28-N30 PolarHBondContact O-N 2.91Å
29	A	34.7	Very low	37	Very low	97 Å²	97	144.5 Å²	144.5	80%	0.802	80%	0.804	S	S	*	*			trans	-77.3	102.7	163.3	0	0	0	0	0	107.7	T27 N31	T27-A29 PolarHBondContact O-N 2.98Å; A29-N31 PolarHBondContact O-N 3Å
30	N	33.3	Very low	36.9	Very low	136 Å²	136	142.6 Å²	142.6	73%	0.727	78%	0.784	S	S	*	*			trans	-67.3	109.9	175.6	-148.5	14	0	0	0	108.2	V28	V28-N30 PolarHBondContact O-N 2.91Å
31	N	35.5	Very low	37.3	Very low	156 Å²	156	139.8 Å²	139.8	83%	0.834	77%	0.77	S	S	*	*			trans	-163	127.4	159.1	-90.5	-25.3	0	0	0	109.7	A29 A33	A29-N31 PolarHBondContact O-N 3Å; N31-A33 VanDerWaalsContact C-N 3.27Å; N31-A33 PolarHBondContact O-N 3.31Å
32	N	36.5	Very low	37.6	Very low	170 Å²	170	138.5 Å²	138.5	91%	0.909	77%	0.768	S	S	*	*			trans	-68.3	70.5	-176.2	-70.1	-24.7	0	0	0	112.9
33	A	33.1	Very low	37.9	Very low	78 Å²	78	140.1 Å²	140.1	65%	0.645	77%	0.768	S	S	*	*			trans	-102.6	89.1	164.2	0	0	0	0	0	108.6	N31 E35	N31-A33 VanDerWaalsContact C-N 3.27Å; N31-A33 PolarHBondContact O-N 3.31Å; A33-E35 PolarHBondContact O-N 2.93Å
34	S	32.6	Very low	38.5	Very low	127 Å²	127	135.1 Å²	135.1	89%	0.888	74%	0.742	S	S	*	*			trans	-70.6	68.6	161	175.5	0	0	0	0	108.5
35	E	35	Very low	39.4	Very low	162 Å²	162	129.3 Å²	129.3	76%	0.757	71%	0.713	S	S	*	*			trans	-114.7	122	165.6	-82.2	-172.2	154.5	0	0	108.4	A33 R37	A33-E35 PolarHBondContact O-N 2.93Å; E35-R37 PolarHBondContact O-N 3.36Å
36	L	35.9	Very low	40.4	Very low	170 Å²	170	124.3 Å²	124.3	89%	0.89	70%	0.695	S	S	*	*			trans	-40.5	113	178.3	-69.9	114.9	0	0	0	110.5	S38	L36-S38 PolarHBondContact O-N 3.02Å
37	R	40.8	Very low	40.9	Very low	246 Å²	246	123.8 Å²	123.8	93%	0.928	69%	0.688	S	S	*	*			trans	-67.9	64.7	167.1	-68.8	-177.3	178.5	177	-0.6	109.6	E35 S39	E35-R37 PolarHBondContact O-N 3.36Å; R37-S39 PolarHBondContact O-N 3.07Å
38	S	37.6	Very low	41.4	Very low	107 Å²	107	119 Å²	119	75%	0.748	66%	0.658	S	S	*	*			trans	-76.5	76.4	157.7	-167.7	0	0	0	0	105.8	L36 S40	L36-S38 PolarHBondContact O-N 3.02Å; S38-S40 VanDerWaalsContact C-N 3.27Å; S38-S40 PolarHBondContact O-N 2.65Å
39	S	45.2	Very low	42.1	Very low	94 Å²	94	118.9 Å²	118.9	66%	0.657	65%	0.652	S	S	*	*			trans	-61.3	98.4	169.2	53.4	0	0	0	0	106.6	R37 N41	R37-S39 PolarHBondContact O-N 3.07Å; S39-N41 PolarHBondContact O-N 3.47Å
40	S	41.1	Very low	43.3	Very low	55 Å²	55	115.5 Å²	115.5	39%	0.385	62%	0.622	S	S	.	*			trans	-49.9	105.5	172.7	163.2	0	0	0	0	109	S38 L42 L43	S38-S40 VanDerWaalsContact C-N 3.27Å; S38-S40 PolarHBondContact O-N 2.65Å; S40-L42 PolarHBondContact O-N 3.31Å; S40-L42 VanDerWaalsContact O-N 3.1Å; S40-L43 PolarHBondContact O-N 2.92Å
41	N	45.2	Very low	45.4	Very low	112 Å²	112	113.5 Å²	113.5	60%	0.599	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-15.9	175.1	-81.3	-37.3	0	0	0	112.2	S39 L43 N44	S39-N41 PolarHBondContact O-N 3.47Å; N41-L43 PolarHBondContact O-N 2.78Å; N41-N44 PolarHBondContact O-N 3.08Å
42	L	43.4	Very low	48	Very low	152 Å²	152	106.7 Å²	106.7	80%	0.796	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-25.2	172.9	-65.7	170.4	0	0	0	112.5	S40	S40-L42 PolarHBondContact O-N 3.31Å; S40-L42 VanDerWaalsContact O-N 3.1Å
43	L	46.2	Very low	50.6	Low	135 Å²	135	98.6 Å²	98.6	71%	0.707	53%	0.53	S	S	*	.	S	Bend	trans	-97.4	-6.7	175.9	-72.1	169.2	0	0	0	113.1	S40 N41 W45	S40-L43 PolarHBondContact O-N 2.92Å; N41-L43 PolarHBondContact O-N 2.78Å; L43-W45 PolarHBondContact O-N 2.86Å
44	N	51.1	Low	53.4	Low	59 Å²	59	95.9 Å²	95.9	32%	0.316	50%	0.503	S	S	.	.			trans	-73	85.1	170.9	-170.1	-3.2	0	0	0	107.9	N41 R46 N47 T48	N41-N44 PolarHBondContact O-N 3.08Å; N44-R46 PolarHBondContact O-N 3.32Å; N44-R46 VanDerWaalsContact O-N 3.12Å; N44-R46 WeakPolarHBondContact OD1-CB 3.12Å; N44-R46 PolarHBondContact OD1-N 3.31Å; N44-N47 HydrophobicContact CB-CB 4.21Å; N44-N47 PolarHBondContact ND2-ND2 2.8Å; N44-N47 WeakPolarHBondContact O-CA 3.32Å; N44-N47 WeakPolarHBondContact O-CB 3.27Å; N44-N47 PolarHBondContact O-N 2.86Å; N44-T48 PolarHBondContact O-N 3.25Å; N44-T48 VanDerWaalsContact O-N 3.1Å
45	W	56.8	Low	56.3	Low	27 Å²	27	89.9 Å²	89.9	10%	0.102	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.5	-174.5	76.8	-90.3	0	0	0	112	L43 N47 T48 R54 C87 S89	L43-W45 PolarHBondContact O-N 2.86Å; W45-N47 PolarHBondContact O-N 3.01Å; W45-T48 WeakPolarHBondContact CA-OG1 3.32Å; W45-T48 PolarHBondContact O-N 3.2Å; W45-T48 PolarHBondContact O-OG1 3.31Å; W45-R54 VanDerWaalsContact CD1-NH1 3.35Å; W45-R54 VanDerWaalsContact CG-NH1 3.3Å; W45-C87 HydrophobicContact CH2-CB 3.58Å; W45-C87 HydrophobicContact CZ2-CB 3.88Å; W45-S89 VanDerWaalsContact CZ3-CA 3.5Å
46	R	53.6	Low	59	Low	139 Å²	139	82.7 Å²	82.7	53%	0.525	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.3	173.4	-61.6	-173.9	175.7	-156.1	-2.2	112.3	N44 E61	N44-R46 PolarHBondContact O-N 3.32Å; N44-R46 VanDerWaalsContact O-N 3.12Å; N44-R46 WeakPolarHBondContact OD1-CB 3.12Å; N44-R46 PolarHBondContact OD1-N 3.31Å; R46-E61 IonicContact NH2-OE1 2.71Å; R46-E61 PolarHBondContact NH2-OE1 3.29Å; R46-E61 IonicContact NH2-OE2 2.81Å; R46-E61 PolarHBondContact NH2-OE2 3.4Å; R46-E61 VanDerWaalsContact NH2-OE2 3.17Å
47	N	48.9	Very low	61.7	Low	101 Å²	101	76 Å²	76	54%	0.54	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-21.3	175.9	-72.8	-6.1	0	0	0	113.3	N44 W45	N44-N47 HydrophobicContact CB-CB 4.21Å; N44-N47 PolarHBondContact ND2-ND2 2.8Å; N44-N47 WeakPolarHBondContact O-CA 3.32Å; N44-N47 WeakPolarHBondContact O-CB 3.27Å; N44-N47 PolarHBondContact O-N 2.86Å; W45-N47 PolarHBondContact O-N 3.01Å
48	T	47.1	Very low	64.1	Low	42 Å²	42	64.8 Å²	64.8	26%	0.258	35%	0.354	S	S	.	.	S	Bend	trans	-72.7	141.8	173.9	46.2	0	0	0	0	110	N44 W45 S50	N44-T48 PolarHBondContact O-N 3.25Å; N44-T48 VanDerWaalsContact O-N 3.1Å; W45-T48 WeakPolarHBondContact CA-OG1 3.32Å; W45-T48 PolarHBondContact O-N 3.2Å; W45-T48 PolarHBondContact O-OG1 3.31Å; T48-S50 WeakPolarHBondContact CB-OG 3.21Å; T48-S50 PolarHBondContact O-N 3.19Å; T48-S50 PolarHBondContact OG1-OG 2.75Å
49	I	51.8	Low	66.8	Low	132 Å²	132	61.3 Å²	61.3	68%	0.677	33%	0.329	S	S	*	.			trans	-69.2	44.6	176.1	-55.7	159.3	0	0	0	110	Q51 T92	I49-Q51 PolarHBondContact O-N 3.05Å; I49-T92 HydrophobicContact CG1-CG2 4.34Å
50	S	59.1	Low	69.1	Low	25 Å²	25	61.5 Å²	61.5	18%	0.175	32%	0.322	C	S	.	.			trans	-82.8	100.3	179.3	-40.2	0	0	0	0	106.2	T48 C52 S89	T48-S50 WeakPolarHBondContact CB-OG 3.21Å; T48-S50 PolarHBondContact O-N 3.19Å; T48-S50 PolarHBondContact OG1-OG 2.75Å; S50-C52 PolarHBondContact O-N 3.34Å; S50-S89 WeakPolarHBondContact O-CB 3.43Å
51	Q	77.5	Confident	71.6	Confident	94 Å²	94	61.4 Å²	61.4	44%	0.439	32%	0.316	S	S	.	.			trans	-64.1	1	169.9	-68	-178.6	-1.9	0	0	112.6	I49 I98 W100	I49-Q51 PolarHBondContact O-N 3.05Å; Q51-I98 HydrophobicContact CB-CD1 3.64Å; Q51-I98 HydrophobicContact CG-CD1 3.59Å; Q51-W100 VanDerWaalsContact O-CZ2 3.23Å; Q51-W100 WeakPolarHBondContact O-CZ2 3.33Å; Q51-W100 PolarHBondContact O-NE1 2.04Å
52	C	89.1	Confident	73.8	Confident	14 Å²	14	61 Å²	61	10%	0.095	31%	0.313	C	S	.	.	S	Bend	trans	-78.7	150.8	-173.4	-38.5	0	0	0	0	112.6	S50 D67 I68 C69	S50-C52 PolarHBondContact O-N 3.34Å; C52-D67 HydrophobicContact CB-CB 4.13Å; C52-I68 CarbonylContact C-O 3.49Å; C52-I68 WeakPolarHBondContact CA-O 3.25Å; C52-I68 VanDerWaalsContact CB-O 3.27Å; C52-I68 WeakPolarHBondContact CB-O 3.13Å; C52-C69 HydrophobicContact CB-CB 3.91Å; C52-C69 WeakPolarHBondContact CB-SG 3.47Å; C52-C69 VanDerWaalsContact SG-CA 3.59Å; C52-C69 WeakPolarHBondContact SG-CB 3.29Å; C52-C69 CovalentContact SG-SG 2.03Å; C52-C69 PolarHBondContact SG-SG 2.94Å
53	V	91.5	Very high	76	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.3	162.2	61.4	0	0	0	0	108.7	L55 I68 T88 W100 L115 I135	V53-L55 HydrophobicContact CB-CD1 4.49Å; V53-L55 HydrophobicContact CG1-CD1 3.89Å; V53-L55 HydrophobicContact CG2-CD1 4.11Å; V53-I68 HydrophobicContact CG1-CB 3.92Å; V53-I68 HydrophobicContact CG1-CG2 4.35Å; V53-I68 PolarHBondContact N-O 2.86Å; V53-I68 PolarHBondContact O-N 3.41Å; V53-T88 HydrophobicContact CB-CG2 4.46Å; V53-T88 HydrophobicContact CG2-CG2 4.21Å; V53-W100 HydrophobicContact CB-CD2 3.94Å; V53-W100 HydrophobicContact CB-CE3 4.47Å; V53-W100 HydrophobicContact CB-CG 4.05Å; V53-W100 HydrophobicContact CG1-CD2 3.83Å; V53-W100 HydrophobicContact CG1-CE3 3.86Å; V53-W100 HydrophobicContact CG1-CG 4.35Å; V53-W100 HydrophobicContact CG1-CH2 4.29Å; V53-W100 HydrophobicContact CG1-CZ2 4.31Å; V53-W100 HydrophobicContact CG1-CZ3 4.08Å; V53-L115 HydrophobicContact CG2-CD1 4.32Å; V53-I135 HydrophobicContact CG1-CD1 4.27Å; V53-I135 HydrophobicContact CG1-CG2 4.24Å
54	R	92	Very high	78.2	Confident	21 Å²	21	55.6 Å²	55.6	8%	0.079	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.2	173.9	-176.3	164.8	-72.8	-171.4	-3	109.7	W45 Y56 W65 D67 M86 C87	W45-R54 VanDerWaalsContact CD1-NH1 3.35Å; W45-R54 VanDerWaalsContact CG-NH1 3.3Å; R54-Y56 HydrophobicContact CB-CE2 4.12Å; R54-Y56 WeakPolarHBondContact CD-OH 3.08Å; R54-Y56 HydrophobicContact CG-CD2 4.14Å; R54-Y56 HydrophobicContact CG-CE1 4.4Å; R54-Y56 HydrophobicContact CG-CE2 3.55Å; R54-W65 HydrophobicContact CG-CB 4.11Å; R54-W65 HydrophobicContact CG-CE3 4.4Å; R54-W65 VanDerWaalsContact CZ-CE3 3.43Å; R54-D67 WeakPolarHBondContact CA-OD1 3.39Å; R54-D67 WeakPolarHBondContact CB-OD1 3.44Å; R54-D67 VanDerWaalsContact CG-OD1 3.3Å; R54-D67 WeakPolarHBondContact CG-OD1 3.47Å; R54-D67 IonicContact CZ-OD1 3.63Å; R54-D67 IonicContact CZ-OD2 3.92Å; R54-D67 IonicContact NE-OD1 3.63Å; R54-D67 PolarHBondContact NE-OD1 3.27Å; R54-D67 IonicContact NE-OD2 3.22Å; R54-D67 IonicContact NH2-OD1 2.77Å; R54-D67 PolarHBondContact NH2-OD1 2.84Å; R54-D67 IonicContact NH2-OD2 2.71Å; R54-D67 PolarHBondContact NH2-OD2 3.43Å; R54-M86 CarbonylContact O-C 3.53Å; R54-M86 WeakPolarHBondContact O-CA 3.46Å; R54-M86 WeakPolarHBondContact O-CB 3.48Å; R54-C87 PolarHBondContact N-O 2.68Å; R54-C87 PolarHBondContact O-N 2.85Å
55	L	92.8	Very high	80	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.4	175.8	-70.8	78.8	0	0	0	108.6	V53 W65 F66 I68 L75 A83 M86 T132 I135	V53-L55 HydrophobicContact CB-CD1 4.49Å; V53-L55 HydrophobicContact CG1-CD1 3.89Å; V53-L55 HydrophobicContact CG2-CD1 4.11Å; L55-W65 CarbonylContact O-C 3.55Å; L55-W65 WeakPolarHBondContact O-CA 3.35Å; L55-F66 HydrophobicContact CB-CD1 4.14Å; L55-F66 HydrophobicContact CB-CD2 4.29Å; L55-F66 HydrophobicContact CB-CE1 3.5Å; L55-F66 VanDerWaalsContact CB-CE1 3.5Å; L55-F66 HydrophobicContact CB-CE2 3.69Å; L55-F66 HydrophobicContact CB-CG 4.49Å; L55-F66 HydrophobicContact CB-CZ 3.24Å; L55-F66 HydrophobicContact CD1-CE2 4.09Å; L55-F66 HydrophobicContact CD1-CZ 4.43Å; L55-F66 HydrophobicContact CD2-CE2 3.77Å; L55-F66 HydrophobicContact CD2-CZ 3.5Å; L55-F66 HydrophobicContact CG-CE2 4.05Å; L55-F66 HydrophobicContact CG-CZ 3.88Å; L55-F66 PolarHBondContact N-O 3.39Å; L55-F66 PolarHBondContact O-N 3.01Å; L55-I68 HydrophobicContact CD1-CB 4.5Å; L55-I68 HydrophobicContact CD1-CD1 3.97Å; L55-I68 HydrophobicContact CD1-CG1 4.29Å; L55-I68 HydrophobicContact CD2-CD1 4.46Å; L55-L75 HydrophobicContact CD2-CD1 4.35Å; L55-A83 HydrophobicContact CB-CB 4.38Å; L55-A83 HydrophobicContact CD2-CB 3.9Å; L55-M86 HydrophobicContact CG-CB 4.34Å; L55-T132 HydrophobicContact CD2-CG2 3.56Å; L55-I135 HydrophobicContact CD1-CD1 4.05Å; L55-I135 HydrophobicContact CD2-CD1 4Å
56	Y	92.6	Very high	81.6	Confident	11 Å²	11	58.8 Å²	58.8	4%	0.043	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.8	-178.6	-64.7	-96.4	0	0	0	109.9	R54 G58 E61 D64 W65 A83 Q84 S85 C87	R54-Y56 HydrophobicContact CB-CE2 4.12Å; R54-Y56 WeakPolarHBondContact CD-OH 3.08Å; R54-Y56 HydrophobicContact CG-CD2 4.14Å; R54-Y56 HydrophobicContact CG-CE1 4.4Å; R54-Y56 HydrophobicContact CG-CE2 3.55Å; Y56-G58 VanDerWaalsContact C-N 3.31Å; Y56-E61 HydrophobicContact CD1-CB 4.27Å; Y56-E61 VanDerWaalsContact CD1-O 3.29Å; Y56-E61 WeakPolarHBondContact CD1-O 2.94Å; Y56-E61 HydrophobicContact CD2-CB 4.32Å; Y56-E61 HydrophobicContact CD2-CG 4.42Å; Y56-E61 HydrophobicContact CE1-CB 3.92Å; Y56-E61 VanDerWaalsContact CE1-O 3.26Å; Y56-E61 WeakPolarHBondContact CE1-O 3.31Å; Y56-E61 HydrophobicContact CE2-CB 3.99Å; Y56-E61 HydrophobicContact CE2-CG 3.97Å; Y56-E61 HydrophobicContact CG-CB 4.45Å; Y56-D64 WeakPolarHBondContact CA-O 2.95Å; Y56-W65 HydrophobicContact CD1-CB 3.71Å; Y56-W65 HydrophobicContact CE1-CB 3.86Å; Y56-W65 HydrophobicContact CE1-CG 4.41Å; Y56-W65 HydrophobicContact CG-CB 4.33Å; Y56-A83 CarbonylContact O-C 3.54Å; Y56-A83 WeakPolarHBondContact O-CA 3.5Å; Y56-Q84 PolarHBondContact O-N 2.92Å; Y56-S85 WeakPolarHBondContact CB-OG 3.46Å; Y56-S85 WeakPolarHBondContact CD2-OG 3.24Å; Y56-S85 PolarHBondContact N-O 3.17Å; Y56-S85 PolarHBondContact O-N 3.37Å; Y56-C87 HydrophobicContact CE2-CB 4.33Å
57	T	92.8	Very high	83.3	Confident	31 Å²	31	55 Å²	55	19%	0.19	30%	0.298	C	S	.	.	S	Bend	trans	-77.1	-17.4	-179.7	53.9	0	0	0	0	113.8	D64 R82 Q84	T57-D64 HydrophobicContact CG2-CB 3.93Å; T57-D64 WeakPolarHBondContact CG2-O 3.22Å; T57-D64 PolarHBondContact N-O 2.9Å; T57-D64 PolarHBondContact OG1-N 3.03Å; T57-D64 PolarHBondContact OG1-O 2.93Å; T57-R82 CarbonylContact C-O 3.52Å; T57-R82 VanDerWaalsContact CA-O 3.25Å; T57-R82 WeakPolarHBondContact CA-O 3.19Å; T57-R82 HydrophobicContact CG2-CB 4.13Å; T57-R82 VanDerWaalsContact O-O 3.07Å; T57-Q84 WeakPolarHBondContact O-CG 3.36Å; T57-Q84 PolarHBondContact O-NE2 3.28Å
58	G	91.9	Very high	85.3	Confident	10 Å²	10	51.1 Å²	51.1	10%	0.103	28%	0.276	C	S	.	.	S	Bend	trans	-117.7	167.4	174.8	0	0	0	0	0	112.8	Y56 L62 Q84 S85	Y56-G58 VanDerWaalsContact C-N 3.31Å; G58-L62 VanDerWaalsContact CA-O 3.29Å; G58-L62 WeakPolarHBondContact CA-O 3.36Å; G58-L62 PolarHBondContact N-O 2.83Å; G58-Q84 VanDerWaalsContact C-CB 3.49Å; G58-S85 WeakPolarHBondContact O-CB 3.39Å; G58-S85 PolarHBondContact O-N 2.87Å; G58-S85 PolarHBondContact O-OG 2.82Å
59	P	93.6	Very high	87.4	Confident	34 Å²	34	51.8 Å²	51.8	22%	0.221	28%	0.283	C	S	.	.	S	Bend	trans	-71.8	159.2	174.2	31.9	-34.6	0	0	0	111.1	L62 D122 D123	P59-L62 VanDerWaalsContact O-CB 3.26Å; P59-L62 WeakPolarHBondContact O-CB 3.38Å; P59-L62 WeakPolarHBondContact O-CD1 3.41Å; P59-L62 VanDerWaalsContact O-CG 3.24Å; P59-L62 WeakPolarHBondContact O-CG 3.37Å; P59-L62 PolarHBondContact O-N 3.12Å; P59-D122 CarbonylContact C-O 3.47Å; P59-D122 WeakPolarHBondContact CA-O 3.4Å; P59-D123 HydrophobicContact CB-CB 4.23Å
60	N	93.9	Very high	89.2	Confident	97 Å²	97	51.1 Å²	51.1	52%	0.519	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	42.3	177.6	-48.4	-70.9	0	0	0	114.3	L62 D122	N60-L62 PolarHBondContact O-N 2.92Å; N60-D122 PolarHBondContact N-O 2.79Å; N60-D122 WeakPolarHBondContact OD1-CB 3.39Å
61	E	92	Very high	90.8	Very high	53 Å²	53	50.9 Å²	50.9	25%	0.248	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	28.3	179.3	-55.1	172.8	-125	0	0	113	R46 Y56 S85 C87	R46-E61 IonicContact NH2-OE1 2.71Å; R46-E61 PolarHBondContact NH2-OE1 3.29Å; R46-E61 IonicContact NH2-OE2 2.81Å; R46-E61 PolarHBondContact NH2-OE2 3.4Å; R46-E61 VanDerWaalsContact NH2-OE2 3.17Å; Y56-E61 HydrophobicContact CD1-CB 4.27Å; Y56-E61 VanDerWaalsContact CD1-O 3.29Å; Y56-E61 WeakPolarHBondContact CD1-O 2.94Å; Y56-E61 HydrophobicContact CD2-CB 4.32Å; Y56-E61 HydrophobicContact CD2-CG 4.42Å; Y56-E61 HydrophobicContact CE1-CB 3.92Å; Y56-E61 VanDerWaalsContact CE1-O 3.26Å; Y56-E61 WeakPolarHBondContact CE1-O 3.31Å; Y56-E61 HydrophobicContact CE2-CB 3.99Å; Y56-E61 HydrophobicContact CE2-CG 3.97Å; Y56-E61 HydrophobicContact CG-CB 4.45Å; E61-S85 WeakPolarHBondContact CA-OG 3.26Å; E61-S85 PolarHBondContact N-OG 3.04Å; E61-C87 WeakPolarHBondContact CG-SG 3.41Å
62	L	91.4	Very high	91.6	Very high	105 Å²	105	48.7 Å²	48.7	55%	0.55	27%	0.27	S	S	.	.			trans	-101.8	158.3	-177.9	-60.2	177.6	0	0	0	113.2	G58 P59 N60	G58-L62 VanDerWaalsContact CA-O 3.29Å; G58-L62 WeakPolarHBondContact CA-O 3.36Å; G58-L62 PolarHBondContact N-O 2.83Å; P59-L62 VanDerWaalsContact O-CB 3.26Å; P59-L62 WeakPolarHBondContact O-CB 3.38Å; P59-L62 WeakPolarHBondContact O-CD1 3.41Å; P59-L62 VanDerWaalsContact O-CG 3.24Å; P59-L62 WeakPolarHBondContact O-CG 3.37Å; P59-L62 PolarHBondContact O-N 3.12Å; N60-L62 PolarHBondContact O-N 2.92Å
63	G	90.8	Very high	91.7	Very high	56 Å²	56	49.3 Å²	49.3	58%	0.577	27%	0.271	S	S	*	.	S	Bend	trans	84.6	-163.8	175.8	0	0	0	0	0	113.8
64	D	91.2	Very high	91.7	Very high	117 Å²	117	50.6 Å²	50.6	63%	0.626	28%	0.278	S	S	*	.			trans	-62.1	146.5	173.3	-63.8	-31.3	0	0	0	110	Y56 T57	Y56-D64 WeakPolarHBondContact CA-O 2.95Å; T57-D64 HydrophobicContact CG2-CB 3.93Å; T57-D64 WeakPolarHBondContact CG2-O 3.22Å; T57-D64 PolarHBondContact N-O 2.9Å; T57-D64 PolarHBondContact OG1-N 3.03Å; T57-D64 PolarHBondContact OG1-O 2.93Å
65	W	90	Very high	91.6	Very high	130 Å²	130	49.8 Å²	49.8	49%	0.492	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	156.9	-179.6	60.1	-91.6	0	0	0	111.3	R54 L55 Y56	R54-W65 HydrophobicContact CG-CB 4.11Å; R54-W65 HydrophobicContact CG-CE3 4.4Å; R54-W65 VanDerWaalsContact CZ-CE3 3.43Å; L55-W65 CarbonylContact O-C 3.55Å; L55-W65 WeakPolarHBondContact O-CA 3.35Å; Y56-W65 HydrophobicContact CD1-CB 3.71Å; Y56-W65 HydrophobicContact CE1-CB 3.86Å; Y56-W65 HydrophobicContact CE1-CG 4.41Å; Y56-W65 HydrophobicContact CG-CB 4.33Å
66	F	89.5	Confident	91.1	Very high	23 Å²	23	52.9 Å²	52.9	10%	0.101	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	146.3	173.1	60.4	-79.8	0	0	0	110	L55 I68 F79	L55-F66 HydrophobicContact CB-CD1 4.14Å; L55-F66 HydrophobicContact CB-CD2 4.29Å; L55-F66 HydrophobicContact CB-CE1 3.5Å; L55-F66 VanDerWaalsContact CB-CE1 3.5Å; L55-F66 HydrophobicContact CB-CE2 3.69Å; L55-F66 HydrophobicContact CB-CG 4.49Å; L55-F66 HydrophobicContact CB-CZ 3.24Å; L55-F66 HydrophobicContact CD1-CE2 4.09Å; L55-F66 HydrophobicContact CD1-CZ 4.43Å; L55-F66 HydrophobicContact CD2-CE2 3.77Å; L55-F66 HydrophobicContact CD2-CZ 3.5Å; L55-F66 HydrophobicContact CG-CE2 4.05Å; L55-F66 HydrophobicContact CG-CZ 3.88Å; L55-F66 PolarHBondContact N-O 3.39Å; L55-F66 PolarHBondContact O-N 3.01Å; F66-I68 HydrophobicContact CD2-CD1 4.17Å; F66-I68 HydrophobicContact CD2-CG1 4.09Å; F66-I68 HydrophobicContact CE2-CD1 3.7Å; F66-I68 HydrophobicContact CE2-CG1 4.13Å; F66-F79 HydrophobicContact CB-CE1 4.14Å; F66-F79 HydrophobicContact CB-CZ 4.2Å; F66-F79 AromaticContact CD1-CD1 3.29Å; F66-F79 HydrophobicContact CD1-CD1 3.29Å; F66-F79 AromaticContact CD1-CE1 3.38Å; F66-F79 HydrophobicContact CD1-CE1 3.38Å; F66-F79 HydrophobicContact CD1-CG 4.03Å; F66-F79 HydrophobicContact CD1-CZ 4.2Å; F66-F79 HydrophobicContact CD2-CD1 4.12Å; F66-F79 HydrophobicContact CD2-CD2 4.2Å; F66-F79 HydrophobicContact CD2-CE1 4.3Å; F66-F79 HydrophobicContact CD2-CE2 4.39Å; F66-F79 HydrophobicContact CD2-CG 4.07Å; F66-F79 HydrophobicContact CD2-CZ 4.43Å; F66-F79 HydrophobicContact CE1-CB 3.94Å; F66-F79 AromaticContact CE1-CD1 3.15Å; F66-F79 HydrophobicContact CE1-CD1 3.15Å; F66-F79 AromaticContact CE1-CE1 3.8Å; F66-F79 HydrophobicContact CE1-CE1 3.8Å; F66-F79 AromaticContact CE1-CG 3.69Å; F66-F79 HydrophobicContact CE1-CG 3.69Å; F66-F79 HydrophobicContact CE2-CB 3.84Å; F66-F79 AromaticContact CE2-CD1 3.99Å; F66-F79 HydrophobicContact CE2-CD1 3.99Å; F66-F79 HydrophobicContact CE2-CD2 4.1Å; F66-F79 AromaticContact CE2-CG 3.7Å; F66-F79 HydrophobicContact CE2-CG 3.7Å; F66-F79 AromaticContact CG-CD1 3.79Å; F66-F79 HydrophobicContact CG-CD1 3.79Å; F66-F79 AromaticContact CG-CE1 3.67Å; F66-F79 HydrophobicContact CG-CE1 3.67Å; F66-F79 HydrophobicContact CG-CE2 4.42Å; F66-F79 HydrophobicContact CG-CG 4.22Å; F66-F79 HydrophobicContact CG-CZ 4.02Å; F66-F79 HydrophobicContact CZ-CB 3.41Å; F66-F79 VanDerWaalsContact CZ-CB 3.41Å; F66-F79 AromaticContact CZ-CD1 3.53Å; F66-F79 HydrophobicContact CZ-CD1 3.53Å; F66-F79 HydrophobicContact CZ-CD2 4.36Å; F66-F79 HydrophobicContact CZ-CE1 4.39Å; F66-F79 AromaticContact CZ-CG 3.5Å; F66-F79 HydrophobicContact CZ-CG 3.5Å
67	D	90.6	Very high	90.4	Very high	59 Å²	59	57 Å²	57	32%	0.316	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.1	-179.5	-69.7	-26.2	0	0	0	110.7	C52 R54	C52-D67 HydrophobicContact CB-CB 4.13Å; R54-D67 WeakPolarHBondContact CA-OD1 3.39Å; R54-D67 WeakPolarHBondContact CB-OD1 3.44Å; R54-D67 VanDerWaalsContact CG-OD1 3.3Å; R54-D67 WeakPolarHBondContact CG-OD1 3.47Å; R54-D67 IonicContact CZ-OD1 3.63Å; R54-D67 IonicContact CZ-OD2 3.92Å; R54-D67 IonicContact NE-OD1 3.63Å; R54-D67 PolarHBondContact NE-OD1 3.27Å; R54-D67 IonicContact NE-OD2 3.22Å; R54-D67 IonicContact NH2-OD1 2.77Å; R54-D67 PolarHBondContact NH2-OD1 2.84Å; R54-D67 IonicContact NH2-OD2 2.71Å; R54-D67 PolarHBondContact NH2-OD2 3.43Å
68	I	91	Very high	89.7	Confident	19 Å²	19	60 Å²	60	10%	0.097	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.5	171.7	-66.9	177.1	0	0	0	107.8	C52 V53 L55 F66 D70 L75 W100 I135	C52-I68 CarbonylContact C-O 3.49Å; C52-I68 WeakPolarHBondContact CA-O 3.25Å; C52-I68 VanDerWaalsContact CB-O 3.27Å; C52-I68 WeakPolarHBondContact CB-O 3.13Å; V53-I68 HydrophobicContact CG1-CB 3.92Å; V53-I68 HydrophobicContact CG1-CG2 4.35Å; V53-I68 PolarHBondContact N-O 2.86Å; V53-I68 PolarHBondContact O-N 3.41Å; L55-I68 HydrophobicContact CD1-CB 4.5Å; L55-I68 HydrophobicContact CD1-CD1 3.97Å; L55-I68 HydrophobicContact CD1-CG1 4.29Å; L55-I68 HydrophobicContact CD2-CD1 4.46Å; F66-I68 HydrophobicContact CD2-CD1 4.17Å; F66-I68 HydrophobicContact CD2-CG1 4.09Å; F66-I68 HydrophobicContact CE2-CD1 3.7Å; F66-I68 HydrophobicContact CE2-CG1 4.13Å; I68-D70 WeakPolarHBondContact CG2-O 3.21Å; I68-L75 HydrophobicContact CD1-CD1 3.6Å; I68-L75 HydrophobicContact CD1-CD2 3.49Å; I68-L75 VanDerWaalsContact CD1-CD2 3.49Å; I68-L75 HydrophobicContact CD1-CG 4.22Å; I68-W100 HydrophobicContact CG2-CH2 4.41Å; I68-W100 HydrophobicContact CG2-CZ3 4.27Å; I68-W100 WeakPolarHBondContact O-CH2 3.2Å; I68-I135 HydrophobicContact CD1-CD1 3.59Å; I68-I135 HydrophobicContact CG2-CG2 4.39Å
69	C	89.8	Confident	89	Confident	57 Å²	57	62.1 Å²	62.1	39%	0.385	35%	0.347	S	S	.	.			trans	-104.3	-15.9	-173.3	-55.2	0	0	0	0	113.8	C52	C52-C69 HydrophobicContact CB-CB 3.91Å; C52-C69 WeakPolarHBondContact CB-SG 3.47Å; C52-C69 VanDerWaalsContact SG-CA 3.59Å; C52-C69 WeakPolarHBondContact SG-CB 3.29Å; C52-C69 CovalentContact SG-SG 2.03Å; C52-C69 PolarHBondContact SG-SG 2.94Å
70	D	89.9	Confident	88.5	Confident	118 Å²	118	61 Å²	61	63%	0.631	34%	0.339	S	S	*	.	S	Bend	trans	-130.4	161.7	-179.5	-60.8	-48.5	0	0	0	110.5	I68	I68-D70 WeakPolarHBondContact CG2-O 3.21Å
71	S	93.6	Very high	88.2	Confident	20 Å²	20	65.2 Å²	65.2	14%	0.14	35%	0.348	C	S	.	.			trans	-60.4	138.6	170.4	-64	0	0	0	0	111.6	I135 I137 Q153	S71-I135 CarbonylContact C-O 3.49Å; S71-I135 VanDerWaalsContact CA-O 3.24Å; S71-I135 WeakPolarHBondContact CA-O 3.41Å; S71-I137 WeakPolarHBondContact OG-CG2 3.08Å; S71-I137 PolarHBondContact OG-N 3.47Å; S71-Q153 WeakPolarHBondContact CB-O 3.16Å; S71-Q153 PolarHBondContact OG-O 2.86Å
72	N	93	Very high	88	Confident	48 Å²	48	68.8 Å²	68.8	26%	0.257	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-138	119.7	-179.9	-167.3	-33.1	0	0	0	109.8	L74 L75 F108 S134 I135 R160	N72-L74 PolarHBondContact O-N 2.9Å; N72-L74 PolarHBondContact OD1-N 3.42Å; N72-L74 PolarHBondContact OD1-O 3.28Å; N72-L75 HydrophobicContact CB-CD2 3.77Å; N72-F108 WeakPolarHBondContact O-CE1 3.47Å; N72-S134 WeakPolarHBondContact O-CA 3.21Å; N72-S134 WeakPolarHBondContact O-CB 3.5Å; N72-I135 PolarHBondContact N-O 3.08Å; N72-I135 PolarHBondContact O-N 3.27Å; N72-R160 PolarHBondContact OD1-NH2 3.12Å
73	E	92.1	Very high	88	Confident	26 Å²	26	64.1 Å²	64.1	12%	0.121	34%	0.336	C	S	.	.	S	Bend	trans	-70.3	-18.4	-178.2	78.4	-66.2	161.2	0	0	113.4	H107 F108 S134 P155 W159 R160	E73-H107 PolarHBondContact O-N 3.3Å; E73-F108 VanDerWaalsContact CA-CZ 3.47Å; E73-F108 HydrophobicContact CB-CE2 3.97Å; E73-F108 HydrophobicContact CB-CZ 3.85Å; E73-S134 VanDerWaalsContact O-CB 3.27Å; E73-S134 WeakPolarHBondContact O-CB 3.49Å; E73-P155 HydrophobicContact CB-CG 4.08Å; E73-W159 HydrophobicContact CB-CD2 4.37Å; E73-W159 HydrophobicContact CB-CG 4.12Å; E73-W159 HydrophobicContact CG-CB 3.95Å; E73-W159 HydrophobicContact CG-CG 4.01Å; E73-R160 IonicContact OE1-CZ 3.48Å; E73-R160 VanDerWaalsContact OE1-CZ 3.29Å; E73-R160 IonicContact OE1-NE 3.17Å; E73-R160 PolarHBondContact OE1-NE 3.36Å; E73-R160 IonicContact OE1-NH2 3.4Å; E73-R160 PolarHBondContact OE1-NH2 3.45Å
74	L	91	Very high	88.1	Confident	27 Å²	27	64 Å²	64	14%	0.141	32%	0.32	C	S	.	.	S	Bend	trans	-158.7	109.9	177.9	175.9	63.3	0	0	0	111.6	N72 T133 R160 F162	N72-L74 PolarHBondContact O-N 2.9Å; N72-L74 PolarHBondContact OD1-N 3.42Å; N72-L74 PolarHBondContact OD1-O 3.28Å; L74-T133 CarbonylContact C-O 3.54Å; L74-T133 VanDerWaalsContact CA-O 3.3Å; L74-T133 WeakPolarHBondContact CA-O 3.17Å; L74-T133 HydrophobicContact CD1-CG2 3.61Å; L74-R160 PolarHBondContact O-NH2 3.04Å; L74-F162 HydrophobicContact CD1-CZ 4.14Å; L74-F162 HydrophobicContact CD2-CE1 3.98Å; L74-F162 HydrophobicContact CD2-CZ 3.68Å; L74-F162 HydrophobicContact CG-CZ 4.49Å
75	L	89.4	Confident	88.3	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	29%	0.29	C	S	.	.			trans	-64.9	154.2	173.6	-57.1	-163	0	0	0	111.3	L55 I68 N72 V80 T132 T133 I135	L55-L75 HydrophobicContact CD2-CD1 4.35Å; I68-L75 HydrophobicContact CD1-CD1 3.6Å; I68-L75 HydrophobicContact CD1-CD2 3.49Å; I68-L75 VanDerWaalsContact CD1-CD2 3.49Å; I68-L75 HydrophobicContact CD1-CG 4.22Å; N72-L75 HydrophobicContact CB-CD2 3.77Å; L75-V80 HydrophobicContact CB-CG2 4.13Å; L75-T132 HydrophobicContact CD1-CG2 3.67Å; L75-T132 WeakPolarHBondContact CD1-O 3.2Å; L75-T133 PolarHBondContact N-O 2.71Å; L75-I135 HydrophobicContact CD1-CD1 3.92Å; L75-I135 HydrophobicContact CD1-CG1 4.14Å; L75-I135 HydrophobicContact CD2-CG1 4.38Å
76	S	83.2	Confident	88.5	Confident	65 Å²	65	52.2 Å²	52.2	46%	0.455	27%	0.267	S	S	.	.			trans	-57.1	141	172.1	177.7	0	0	0	0	110.3	M78 F79 V80	S76-M78 PolarHBondContact O-N 3.28Å; S76-F79 PolarHBondContact O-N 3.45Å; S76-V80 PolarHBondContact O-N 3.44Å
77	S	78.7	Confident	88.7	Confident	98 Å²	98	51.1 Å²	51.1	69%	0.685	26%	0.262	S	S	*	.	H	α-helix	trans	-53.7	-28.4	-178.1	55.8	0	0	0	0	113.5	F79	S77-F79 PolarHBondContact O-N 3.4Å
78	M	77	Confident	88.7	Confident	93 Å²	93	48.6 Å²	48.6	46%	0.458	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-31.9	175	-176.3	175.3	175.3	0	0	112.9	S76 R82	S76-M78 PolarHBondContact O-N 3.28Å; M78-R82 WeakPolarHBondContact O-CD 3.35Å; M78-R82 WeakPolarHBondContact O-CG 3.29Å
79	F	76.6	Confident	88.2	Confident	55 Å²	55	48.2 Å²	48.2	24%	0.241	25%	0.248	C	C	.	.	H	α-helix	trans	-101.8	-26.4	-171.8	-62.4	-51.2	0	0	0	113.4	F66 S76 S77 W81 R82 A83	F66-F79 HydrophobicContact CB-CE1 4.14Å; F66-F79 HydrophobicContact CB-CZ 4.2Å; F66-F79 AromaticContact CD1-CD1 3.29Å; F66-F79 HydrophobicContact CD1-CD1 3.29Å; F66-F79 AromaticContact CD1-CE1 3.38Å; F66-F79 HydrophobicContact CD1-CE1 3.38Å; F66-F79 HydrophobicContact CD1-CG 4.03Å; F66-F79 HydrophobicContact CD1-CZ 4.2Å; F66-F79 HydrophobicContact CD2-CD1 4.12Å; F66-F79 HydrophobicContact CD2-CD2 4.2Å; F66-F79 HydrophobicContact CD2-CE1 4.3Å; F66-F79 HydrophobicContact CD2-CE2 4.39Å; F66-F79 HydrophobicContact CD2-CG 4.07Å; F66-F79 HydrophobicContact CD2-CZ 4.43Å; F66-F79 HydrophobicContact CE1-CB 3.94Å; F66-F79 AromaticContact CE1-CD1 3.15Å; F66-F79 HydrophobicContact CE1-CD1 3.15Å; F66-F79 AromaticContact CE1-CE1 3.8Å; F66-F79 HydrophobicContact CE1-CE1 3.8Å; F66-F79 AromaticContact CE1-CG 3.69Å; F66-F79 HydrophobicContact CE1-CG 3.69Å; F66-F79 HydrophobicContact CE2-CB 3.84Å; F66-F79 AromaticContact CE2-CD1 3.99Å; F66-F79 HydrophobicContact CE2-CD1 3.99Å; F66-F79 HydrophobicContact CE2-CD2 4.1Å; F66-F79 AromaticContact CE2-CG 3.7Å; F66-F79 HydrophobicContact CE2-CG 3.7Å; F66-F79 AromaticContact CG-CD1 3.79Å; F66-F79 HydrophobicContact CG-CD1 3.79Å; F66-F79 AromaticContact CG-CE1 3.67Å; F66-F79 HydrophobicContact CG-CE1 3.67Å; F66-F79 HydrophobicContact CG-CE2 4.42Å; F66-F79 HydrophobicContact CG-CG 4.22Å; F66-F79 HydrophobicContact CG-CZ 4.02Å; F66-F79 HydrophobicContact CZ-CB 3.41Å; F66-F79 VanDerWaalsContact CZ-CB 3.41Å; F66-F79 AromaticContact CZ-CD1 3.53Å; F66-F79 HydrophobicContact CZ-CD1 3.53Å; F66-F79 HydrophobicContact CZ-CD2 4.36Å; F66-F79 HydrophobicContact CZ-CE1 4.39Å; F66-F79 AromaticContact CZ-CG 3.5Å; F66-F79 HydrophobicContact CZ-CG 3.5Å; S76-F79 PolarHBondContact O-N 3.45Å; S77-F79 PolarHBondContact O-N 3.4Å; F79-W81 VanDerWaalsContact C-N 3.27Å; F79-W81 PolarHBondContact O-N 3.04Å; F79-R82 PolarHBondContact O-N 3.18Å; F79-A83 PolarHBondContact O-N 2.9Å
80	V	84.7	Confident	87.3	Confident	10 Å²	10	46.7 Å²	46.7	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-51.6	-46	-175.6	173.7	0	0	0	0	112.5	L75 S76 A131 T132 T133	L75-V80 HydrophobicContact CB-CG2 4.13Å; S76-V80 PolarHBondContact O-N 3.44Å; V80-A131 HydrophobicContact CG1-CB 3.86Å; V80-A131 CarbonylContact O-C 3.49Å; V80-A131 VanDerWaalsContact O-CA 3.27Å; V80-A131 WeakPolarHBondContact O-CA 3.43Å; V80-T132 WeakPolarHBondContact CA-O 3.4Å; V80-T132 PolarHBondContact O-N 2.79Å; V80-T133 WeakPolarHBondContact CG1-OG1 3.3Å
81	W	85.8	Confident	86	Confident	186 Å²	186	44 Å²	44	71%	0.705	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-2.4	-174.4	-53.6	104.6	0	0	0	114.1	F79 A131	F79-W81 VanDerWaalsContact C-N 3.27Å; F79-W81 PolarHBondContact O-N 3.04Å; W81-A131 HydrophobicContact CD2-CB 4.44Å; W81-A131 HydrophobicContact CE3-CB 3.78Å; W81-A131 HydrophobicContact CH2-CB 4.13Å; W81-A131 HydrophobicContact CZ3-CB 3.62Å
82	R	88.3	Confident	84.3	Confident	127 Å²	127	46 Å²	46	48%	0.479	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-25.8	-171.4	-67.3	-166.4	-174.8	177.6	-0.6	113.7	T57 M78 F79 Q84	T57-R82 CarbonylContact C-O 3.52Å; T57-R82 VanDerWaalsContact CA-O 3.25Å; T57-R82 WeakPolarHBondContact CA-O 3.19Å; T57-R82 HydrophobicContact CG2-CB 4.13Å; T57-R82 VanDerWaalsContact O-O 3.07Å; M78-R82 WeakPolarHBondContact O-CD 3.35Å; M78-R82 WeakPolarHBondContact O-CG 3.29Å; F79-R82 PolarHBondContact O-N 3.18Å; R82-Q84 PolarHBondContact O-N 3.46Å
83	A	91.3	Very high	82.8	Confident	7 Å²	7	46.2 Å²	46.2	6%	0.058	24%	0.24	C	C	.	.			trans	-58.4	126.6	177.5	0	0	0	0	0	109.8	L55 Y56 F79 I124	L55-A83 HydrophobicContact CB-CB 4.38Å; L55-A83 HydrophobicContact CD2-CB 3.9Å; Y56-A83 CarbonylContact O-C 3.54Å; Y56-A83 WeakPolarHBondContact O-CA 3.5Å; F79-A83 PolarHBondContact O-N 2.9Å; A83-I124 WeakPolarHBondContact O-CD1 3.37Å
84	Q	93.8	Very high	81.4	Confident	53 Å²	53	51 Å²	51	25%	0.248	27%	0.274	C	S	.	.			trans	-124.3	-27.7	178.2	-77.2	-171.9	66.5	0	0	112.2	Y56 T57 G58 R82 D123 I124	Y56-Q84 PolarHBondContact O-N 2.92Å; T57-Q84 WeakPolarHBondContact O-CG 3.36Å; T57-Q84 PolarHBondContact O-NE2 3.28Å; G58-Q84 VanDerWaalsContact C-CB 3.49Å; R82-Q84 PolarHBondContact O-N 3.46Å; Q84-D123 CarbonylContact O-C 3.56Å; Q84-D123 WeakPolarHBondContact O-CA 3.36Å; Q84-I124 PolarHBondContact O-N 2.95Å
85	S	94.7	Very high	80.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	161.5	171	94.6	0	0	0	0	109.7	Y56 G58 E61 I121 D122	Y56-S85 WeakPolarHBondContact CB-OG 3.46Å; Y56-S85 WeakPolarHBondContact CD2-OG 3.24Å; Y56-S85 PolarHBondContact N-O 3.17Å; Y56-S85 PolarHBondContact O-N 3.37Å; G58-S85 WeakPolarHBondContact O-CB 3.39Å; G58-S85 PolarHBondContact O-N 2.87Å; G58-S85 PolarHBondContact O-OG 2.82Å; E61-S85 WeakPolarHBondContact CA-OG 3.26Å; E61-S85 PolarHBondContact N-OG 3.04Å; S85-I121 VanDerWaalsContact CA-O 3.29Å; S85-I121 WeakPolarHBondContact CA-O 3.29Å; S85-I121 WeakPolarHBondContact CB-O 3.18Å; S85-D122 WeakPolarHBondContact CB-O 3.45Å
86	M	94	Very high	79.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	146.8	-178.9	53.6	-178.5	68.4	0	0	111.3	R54 L55 I102 L115 C120 I121 I124	R54-M86 CarbonylContact O-C 3.53Å; R54-M86 WeakPolarHBondContact O-CA 3.46Å; R54-M86 WeakPolarHBondContact O-CB 3.48Å; L55-M86 HydrophobicContact CG-CB 4.34Å; M86-I102 HydrophobicContact CE-CG1 4.49Å; M86-I102 HydrophobicContact CE-CG2 4Å; M86-I102 HydrophobicContact SD-CB 4.43Å; M86-I102 HydrophobicContact SD-CD1 3.96Å; M86-I102 HydrophobicContact SD-CG1 3.96Å; M86-I102 HydrophobicContact SD-CG2 4.45Å; M86-L115 HydrophobicContact CB-CD1 4.38Å; M86-L115 HydrophobicContact CG-CD1 3.7Å; M86-L115 HydrophobicContact SD-CD1 3.56Å; M86-L115 VanDerWaalsContact SD-CD1 3.56Å; M86-C120 CarbonylContact O-C 3.59Å; M86-C120 VanDerWaalsContact O-CA 3.31Å; M86-C120 WeakPolarHBondContact O-CA 3.29Å; M86-I121 HydrophobicContact CG-CB 4.08Å; M86-I121 PolarHBondContact N-O 2.82Å; M86-I121 PolarHBondContact O-N 2.85Å; M86-I121 HydrophobicContact SD-CD1 4.46Å; M86-I124 HydrophobicContact CE-CG2 3.6Å; M86-I124 HydrophobicContact CG-CG2 4.31Å; M86-I124 HydrophobicContact SD-CG2 4.37Å
87	C	93.4	Very high	80.1	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	146	-179.8	-73	0	0	0	0	111.3	W45 R54 Y56 E61 R119 C120	W45-C87 HydrophobicContact CH2-CB 3.58Å; W45-C87 HydrophobicContact CZ2-CB 3.88Å; R54-C87 PolarHBondContact N-O 2.68Å; R54-C87 PolarHBondContact O-N 2.85Å; Y56-C87 HydrophobicContact CE2-CB 4.33Å; E61-C87 WeakPolarHBondContact CG-SG 3.41Å; C87-R119 WeakPolarHBondContact CA-O 3.26Å; C87-C120 HydrophobicContact CB-CB 4.17Å; C87-C120 WeakPolarHBondContact CB-SG 3.35Å; C87-C120 WeakPolarHBondContact SG-CB 3.13Å; C87-C120 CovalentContact SG-SG 2.04Å; C87-C120 PolarHBondContact SG-SG 2.83Å
88	T	91.3	Very high	80.6	Confident	6 Å²	6	56.3 Å²	56.3	4%	0.037	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.7	170	54.8	0	0	0	0	109.3	V53 W100 L115 G116 S118 R119	V53-T88 HydrophobicContact CB-CG2 4.46Å; V53-T88 HydrophobicContact CG2-CG2 4.21Å; T88-W100 HydrophobicContact CG2-CG 4.35Å; T88-L115 HydrophobicContact CG2-CB 3.76Å; T88-L115 HydrophobicContact CG2-CD1 4.09Å; T88-G116 PolarHBondContact OG1-O 2.66Å; T88-S118 PolarHBondContact OG1-N 3.11Å; T88-R119 PolarHBondContact N-O 3.26Å; T88-R119 PolarHBondContact OG1-N 3.01Å; T88-R119 PolarHBondContact OG1-O 3.43Å
89	S	81.3	Confident	81.4	Confident	11 Å²	11	53 Å²	53	8%	0.077	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-66.8	160	174.3	-166.4	0	0	0	0	111.1	W45 S50 S118	W45-S89 VanDerWaalsContact CZ3-CA 3.5Å; S50-S89 WeakPolarHBondContact O-CB 3.43Å; S89-S118 PolarHBondContact O-N 3.24Å; S89-S118 VanDerWaalsContact O-N 3.09Å
90	G	70.9	Confident	82.3	Confident	26 Å²	26	50.5 Å²	50.5	27%	0.268	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-61.6	143.7	170.9	0	0	0	0	0	111	T92 S118	G90-T92 PolarHBondContact O-N 2.81Å; G90-S118 VanDerWaalsContact CA-OG 3.25Å; G90-S118 WeakPolarHBondContact CA-OG 3.46Å
91	N	62.8	Low	82.9	Confident	62 Å²	62	50.1 Å²	50.1	33%	0.332	25%	0.247	S	C	.	.			trans	-64.2	99.8	179.1	-171.8	19.7	0	0	0	110.2	N93 R96 T97 P117	N91-N93 PolarHBondContact ND2-O 2.67Å; N91-N93 PolarHBondContact OD1-N 2.79Å; N91-N93 PolarHBondContact OD1-O 2.86Å; N91-R96 PolarHBondContact OD1-O 2.88Å; N91-T97 PolarHBondContact ND2-OG1 2.81Å; N91-P117 HydrophobicContact CB-CB 3.79Å
92	T	56.1	Low	83.4	Confident	62 Å²	62	41.2 Å²	41.2	38%	0.38	21%	0.214	S	C	.	.			trans	-85.1	-14.5	175.6	48.9	0	0	0	0	112.3	I49 G90 P94	I49-T92 HydrophobicContact CG1-CG2 4.34Å; G90-T92 PolarHBondContact O-N 2.81Å; T92-P94 VanDerWaalsContact O-CD 3.26Å; T92-P94 WeakPolarHBondContact O-CD 3.3Å
93	N	62.4	Low	83.7	Confident	52 Å²	52	36 Å²	36	28%	0.278	19%	0.194	S	C	.	.			trans	-94	107	176.1	-167.2	-19.9	0	0	0	110.1	N91 I95	N91-N93 PolarHBondContact ND2-O 2.67Å; N91-N93 PolarHBondContact OD1-N 2.79Å; N91-N93 PolarHBondContact OD1-O 2.86Å; N93-I95 PolarHBondContact O-N 2.83Å; N93-I95 VanDerWaalsContact O-N 3.09Å; N93-I95 WeakPolarHBondContact OD1-CB 3.43Å; N93-I95 PolarHBondContact OD1-N 2.83Å
94	P	61.8	Low	83.8	Confident	126 Å²	126	37.6 Å²	37.6	82%	0.818	20%	0.2	S	C	*	.	S	Bend	trans	-65.3	-15.9	-180	26.7	-33.4	0	0	0	112.7	T92	T92-P94 VanDerWaalsContact O-CD 3.26Å; T92-P94 WeakPolarHBondContact O-CD 3.3Å
95	I	69.4	Low	83.8	Confident	138 Å²	138	42.3 Å²	42.3	71%	0.708	22%	0.216	S	C	*	.	S	Bend	trans	-91.7	-38.6	-172.7	-51.4	178.1	0	0	0	111.7	N93	N93-I95 PolarHBondContact O-N 2.83Å; N93-I95 VanDerWaalsContact O-N 3.09Å; N93-I95 WeakPolarHBondContact OD1-CB 3.43Å; N93-I95 PolarHBondContact OD1-N 2.83Å
96	R	79	Confident	83.6	Confident	133 Å²	133	43.3 Å²	43.3	50%	0.502	22%	0.223	S	C	.	.			trans	-139.9	126.6	-172.3	-59.5	-172.1	-174.9	-172.7	-0.5	111.4	N91 V139	N91-R96 PolarHBondContact OD1-O 2.88Å; R96-V139 HydrophobicContact CB-CG1 3.88Å; R96-V139 HydrophobicContact CG-CG1 4.48Å
97	T	88.3	Confident	83.6	Confident	14 Å²	14	45.5 Å²	45.5	9%	0.086	23%	0.233	C	C	.	.			trans	-86	140.2	175.3	-60.4	0	0	0	0	110.8	N91 Y99 P117 E140	N91-T97 PolarHBondContact ND2-OG1 2.81Å; T97-Y99 HydrophobicContact CG2-CD2 4.35Å; T97-Y99 HydrophobicContact CG2-CE1 4.29Å; T97-Y99 HydrophobicContact CG2-CE2 3.64Å; T97-P117 HydrophobicContact CG2-CB 4.12Å; T97-P117 VanDerWaalsContact CG2-CD 3.5Å; T97-P117 HydrophobicContact CG2-CG 3.45Å; T97-P117 VanDerWaalsContact CG2-CG 3.45Å; T97-E140 WeakPolarHBondContact CB-OE2 3.14Å; T97-E140 WeakPolarHBondContact O-CB 3.31Å; T97-E140 PolarHBondContact O-N 2.82Å; T97-E140 PolarHBondContact OG1-OE2 2.9Å
98	I	89.9	Confident	83.6	Confident	21 Å²	21	46.3 Å²	46.3	11%	0.108	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	137.2	178.9	-61.2	176.6	0	0	0	108.9	Q51 I137	Q51-I98 HydrophobicContact CB-CD1 3.64Å; Q51-I98 HydrophobicContact CG-CD1 3.59Å; I98-I137 HydrophobicContact CG2-CD1 3.72Å; I98-I137 HydrophobicContact CG2-CG1 3.56Å
99	Y	93.4	Very high	83.6	Confident	23 Å²	23	49.2 Å²	49.2	9%	0.09	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.8	173.9	-59.1	-90.8	0	0	0	108.9	T97 L115 C138 E140 V150 L200	T97-Y99 HydrophobicContact CG2-CD2 4.35Å; T97-Y99 HydrophobicContact CG2-CE1 4.29Å; T97-Y99 HydrophobicContact CG2-CE2 3.64Å; Y99-L115 CarbonylContact C-O 3.43Å; Y99-L115 VanDerWaalsContact CA-O 3.32Å; Y99-L115 WeakPolarHBondContact CA-O 3.17Å; Y99-C138 PolarHBondContact N-O 3.48Å; Y99-C138 PolarHBondContact O-N 2.91Å; Y99-E140 HydrophobicContact CE2-CB 4.39Å; Y99-V150 HydrophobicContact CD2-CG1 3.81Å; Y99-V150 HydrophobicContact CE2-CG1 4Å; Y99-L200 HydrophobicContact CD1-CD1 3.7Å; Y99-L200 HydrophobicContact CD1-CD2 4.42Å; Y99-L200 HydrophobicContact CD2-CD1 4.32Å; Y99-L200 HydrophobicContact CE1-CD1 3.77Å; Y99-L200 HydrophobicContact CE1-CD2 3.63Å; Y99-L200 HydrophobicContact CE1-CG 4.36Å; Y99-L200 HydrophobicContact CE2-CD1 4.37Å; Y99-L200 HydrophobicContact CE2-CD2 4.09Å; Y99-L200 HydrophobicContact CG-CD1 4Å; Y99-L200 VanDerWaalsContact CZ-CD2 3.43Å; Y99-L200 WeakPolarHBondContact OH-CD2 3.44Å
100	W	95.4	Very high	84.2	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.015	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.9	179.9	-72.8	95.8	0	0	0	109.7	Q51 V53 I68 T88 I102 L114 L115 I135 I137	Q51-W100 VanDerWaalsContact O-CZ2 3.23Å; Q51-W100 WeakPolarHBondContact O-CZ2 3.33Å; Q51-W100 PolarHBondContact O-NE1 2.04Å; V53-W100 HydrophobicContact CB-CD2 3.94Å; V53-W100 HydrophobicContact CB-CE3 4.47Å; V53-W100 HydrophobicContact CB-CG 4.05Å; V53-W100 HydrophobicContact CG1-CD2 3.83Å; V53-W100 HydrophobicContact CG1-CE3 3.86Å; V53-W100 HydrophobicContact CG1-CG 4.35Å; V53-W100 HydrophobicContact CG1-CH2 4.29Å; V53-W100 HydrophobicContact CG1-CZ2 4.31Å; V53-W100 HydrophobicContact CG1-CZ3 4.08Å; I68-W100 HydrophobicContact CG2-CH2 4.41Å; I68-W100 HydrophobicContact CG2-CZ3 4.27Å; I68-W100 WeakPolarHBondContact O-CH2 3.2Å; T88-W100 HydrophobicContact CG2-CG 4.35Å; W100-I102 HydrophobicContact CB-CD1 3.96Å; W100-L114 WeakPolarHBondContact O-CA 3.45Å; W100-L115 HydrophobicContact CB-CB 4.26Å; W100-L115 PolarHBondContact N-O 2.81Å; W100-L115 PolarHBondContact O-N 2.84Å; W100-I135 HydrophobicContact CD2-CG2 4.44Å; W100-I135 HydrophobicContact CE3-CG2 3.28Å; W100-I135 HydrophobicContact CZ3-CG2 3.5Å; W100-I137 HydrophobicContact CD2-CB 4.43Å; W100-I137 HydrophobicContact CD2-CG1 4.27Å; W100-I137 HydrophobicContact CE3-CB 4Å; W100-I137 HydrophobicContact CE3-CG1 4.33Å; W100-I137 HydrophobicContact CH2-CB 3.89Å; W100-I137 HydrophobicContact CH2-CD1 3.94Å; W100-I137 HydrophobicContact CH2-CG1 4.04Å; W100-I137 HydrophobicContact CZ2-CB 4.28Å; W100-I137 HydrophobicContact CZ2-CD1 3.69Å; W100-I137 HydrophobicContact CZ2-CG1 3.91Å; W100-I137 HydrophobicContact CZ3-CB 3.73Å; W100-I137 HydrophobicContact CZ3-CG1 4.24Å
101	L	96.9	Very high	85.3	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.8	170.5	-73.1	66.8	0	0	0	108	Y103 Y112 I113 L114 I135 L136 C138 L203	L101-Y103 HydrophobicContact CB-CD2 4.29Å; L101-Y103 HydrophobicContact CB-CE2 3.62Å; L101-Y103 HydrophobicContact CD2-CE2 4.21Å; L101-Y103 WeakPolarHBondContact CD2-OH 3.26Å; L101-Y112 HydrophobicContact CB-CD2 4.27Å; L101-Y112 HydrophobicContact CD2-CD2 4.07Å; L101-Y112 HydrophobicContact CD2-CE2 3.95Å; L101-Y112 HydrophobicContact CG-CD2 3.97Å; L101-Y112 HydrophobicContact CG-CE2 4.11Å; L101-I113 WeakPolarHBondContact CA-O 3.27Å; L101-L114 HydrophobicContact CD1-CD1 3.54Å; L101-L114 HydrophobicContact CG-CD1 4.05Å; L101-I135 CarbonylContact O-C 3.53Å; L101-I135 WeakPolarHBondContact O-CA 3.37Å; L101-L136 HydrophobicContact CB-CB 4.3Å; L101-L136 PolarHBondContact N-O 3.06Å; L101-L136 PolarHBondContact O-N 2.93Å; L101-C138 HydrophobicContact CD1-CB 4.36Å; L101-C138 WeakPolarHBondContact CD1-SG 3.16Å; L101-L203 HydrophobicContact CD1-CD1 4.41Å; L101-L203 HydrophobicContact CD2-CD1 4.42Å; L101-L203 HydrophobicContact CD2-CD2 3.99Å
102	I	96.3	Very high	86.9	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.9	-177.9	-60.6	90.2	0	0	0	107.1	M86 W100 Y112 I113 L115 F129 T132 I135	M86-I102 HydrophobicContact CE-CG1 4.49Å; M86-I102 HydrophobicContact CE-CG2 4Å; M86-I102 HydrophobicContact SD-CB 4.43Å; M86-I102 HydrophobicContact SD-CD1 3.96Å; M86-I102 HydrophobicContact SD-CG1 3.96Å; M86-I102 HydrophobicContact SD-CG2 4.45Å; W100-I102 HydrophobicContact CB-CD1 3.96Å; I102-Y112 CarbonylContact O-C 3.56Å; I102-Y112 WeakPolarHBondContact O-CA 3Å; I102-Y112 VanDerWaalsContact O-CB 3.25Å; I102-Y112 WeakPolarHBondContact O-CB 3.31Å; I102-I113 HydrophobicContact CB-CB 4.35Å; I102-I113 HydrophobicContact CD1-CG2 4.5Å; I102-I113 PolarHBondContact N-O 3.34Å; I102-I113 PolarHBondContact O-N 2.87Å; I102-L115 HydrophobicContact CD1-CB 4.27Å; I102-L115 HydrophobicContact CD1-CD1 3.76Å; I102-L115 HydrophobicContact CD1-CG 3.99Å; I102-F129 HydrophobicContact CG2-CE1 3.9Å; I102-F129 HydrophobicContact CG2-CZ 4.15Å; I102-F129 WeakPolarHBondContact O-CZ 3.42Å; I102-T132 HydrophobicContact CG2-CG2 3.33Å; I102-I135 HydrophobicContact CG1-CD1 4.17Å; I102-I135 HydrophobicContact CG1-CG1 4.22Å; I102-I135 HydrophobicContact CG1-CG2 4.43Å; I102-I135 HydrophobicContact CG2-CD1 4.39Å; I102-I135 HydrophobicContact CG2-CG1 4.18Å
103	Y	96.4	Very high	88.9	Confident	18 Å²	18	47 Å²	47	7%	0.071	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.5	-174	-72.1	-95	0	0	0	112.2	L101 R105 F108 Y112 F129 T133 S134 L136	L101-Y103 HydrophobicContact CB-CD2 4.29Å; L101-Y103 HydrophobicContact CB-CE2 3.62Å; L101-Y103 HydrophobicContact CD2-CE2 4.21Å; L101-Y103 WeakPolarHBondContact CD2-OH 3.26Å; Y103-R105 VanDerWaalsContact C-N 3.28Å; Y103-R105 PolarHBondContact O-N 3.22Å; Y103-F108 VanDerWaalsContact CD1-C 3.41Å; Y103-F108 HydrophobicContact CD2-CB 4.09Å; Y103-F108 HydrophobicContact CD2-CD1 4.14Å; Y103-F108 VanDerWaalsContact CE1-C 3.46Å; Y103-F108 HydrophobicContact CE1-CB 4.44Å; Y103-F108 WeakPolarHBondContact CE1-O 3.4Å; Y103-F108 HydrophobicContact CE2-CB 3.83Å; Y103-F108 HydrophobicContact CE2-CD1 4.27Å; Y103-F108 HydrophobicContact CG-CB 4.5Å; Y103-Y112 HydrophobicContact CD1-CD1 4.26Å; Y103-Y112 HydrophobicContact CD1-CG 4.33Å; Y103-Y112 AromaticContact CE1-CD1 3.63Å; Y103-Y112 HydrophobicContact CE1-CD1 3.63Å; Y103-Y112 AromaticContact CE1-CG 3.94Å; Y103-Y112 HydrophobicContact CE1-CG 3.94Å; Y103-F129 VanDerWaalsContact C-CZ 3.45Å; Y103-T133 PolarHBondContact O-N 2.85Å; Y103-S134 WeakPolarHBondContact CB-OG 3.48Å; Y103-S134 PolarHBondContact N-O 3.4Å; Y103-S134 PolarHBondContact O-N 2.9Å; Y103-L136 HydrophobicContact CE2-CB 4.2Å; Y103-L136 HydrophobicContact CE2-CD2 4.46Å
104	E	93.4	Very high	90.5	Very high	40 Å²	40	45.1 Å²	45.1	19%	0.187	23%	0.234	C	C	.	.	S	Bend	trans	-71.5	-27.2	177.6	-168.4	170.2	-148.8	0	0	112.1	P111 F129 L130 A131 T133	E104-P111 PolarHBondContact N-O 3.1Å; E104-F129 HydrophobicContact CB-CD2 4.13Å; E104-F129 HydrophobicContact CB-CE2 3.61Å; E104-F129 HydrophobicContact CB-CZ 3.95Å; E104-F129 HydrophobicContact CG-CE2 4.44Å; E104-F129 VanDerWaalsContact N-CZ 3.29Å; E104-L130 VanDerWaalsContact OE1-CB 3.3Å; E104-L130 WeakPolarHBondContact OE1-CB 3.36Å; E104-L130 WeakPolarHBondContact OE1-CG 3.5Å; E104-L130 PolarHBondContact OE1-N 3.17Å; E104-A131 WeakPolarHBondContact CA-O 3.25Å; E104-A131 HydrophobicContact CG-CB 4.42Å; E104-T133 WeakPolarHBondContact O-CB 3.21Å; E104-T133 PolarHBondContact O-OG1 2.98Å
105	R	92.5	Very high	92.1	Very high	151 Å²	151	39.3 Å²	39.3	57%	0.57	20%	0.196	S	C	*	.	S	Bend	trans	-113.5	165.5	-178.8	-51.3	-179.9	-178.2	-176.9	-0.9	111.2	Y103 T109 S134	Y103-R105 VanDerWaalsContact C-N 3.28Å; Y103-R105 PolarHBondContact O-N 3.22Å; R105-T109 WeakPolarHBondContact CB-O 3.48Å; R105-S134 WeakPolarHBondContact O-CB 3.34Å; R105-S134 PolarHBondContact O-OG 2.95Å
106	S	91.2	Very high	93.2	Very high	21 Å²	21	33.4 Å²	33.4	15%	0.147	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-67.1	165.7	173.8	58.7	0	0	0	0	111.5	F108 T109 T133 F162	S106-F108 PolarHBondContact O-N 2.9Å; S106-T109 PolarHBondContact O-N 2.95Å; S106-T109 PolarHBondContact O-OG1 3.38Å; S106-T133 VanDerWaalsContact N-CG2 3.34Å; S106-F162 WeakPolarHBondContact OG-CE2 3.37Å
107	H	92.6	Very high	93.6	Very high	46 Å²	46	28.9 Å²	28.9	21%	0.213	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	58.4	29.6	172.3	-47.8	129.9	0	0	0	114.2	E73 T109 W159 R160 F162	E73-H107 PolarHBondContact O-N 3.3Å; H107-T109 VanDerWaalsContact C-N 3.34Å; H107-T109 WeakPolarHBondContact O-CG2 3.03Å; H107-T109 PolarHBondContact O-N 2.52Å; H107-W159 HydrophobicContact CB-CE3 3.81Å; H107-W159 HydrophobicContact CB-CZ3 3.93Å; H107-W159 AromaticContact CD2-CE3 3.74Å; H107-R160 PolarHBondContact CE1-O 2.76Å; H107-R160 PolarHBondContact NE2-O 2.8Å; H107-F162 AromaticContact CE1-CD2 3.69Å; H107-F162 AromaticContact CE1-CE2 3.41Å; H107-F162 VanDerWaalsContact CE1-CE2 3.41Å; H107-F162 WeakPolarHBondContact CE1-CE2 3.3Å
108	F	94.1	Very high	93.5	Very high	17 Å²	17	32.1 Å²	32.1	8%	0.075	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	61.1	39.8	175	-38.1	-65.4	0	0	0	113.3	N72 E73 Y103 S106 S134 I135 L136 Y154 P155 W159	N72-F108 WeakPolarHBondContact O-CE1 3.47Å; E73-F108 VanDerWaalsContact CA-CZ 3.47Å; E73-F108 HydrophobicContact CB-CE2 3.97Å; E73-F108 HydrophobicContact CB-CZ 3.85Å; Y103-F108 VanDerWaalsContact CD1-C 3.41Å; Y103-F108 HydrophobicContact CD2-CB 4.09Å; Y103-F108 HydrophobicContact CD2-CD1 4.14Å; Y103-F108 VanDerWaalsContact CE1-C 3.46Å; Y103-F108 HydrophobicContact CE1-CB 4.44Å; Y103-F108 WeakPolarHBondContact CE1-O 3.4Å; Y103-F108 HydrophobicContact CE2-CB 3.83Å; Y103-F108 HydrophobicContact CE2-CD1 4.27Å; Y103-F108 HydrophobicContact CG-CB 4.5Å; S106-F108 PolarHBondContact O-N 2.9Å; F108-S134 PolarHBondContact N-OG 3.24Å; F108-I135 WeakPolarHBondContact CE1-O 3.06Å; F108-L136 HydrophobicContact CD1-CB 3.77Å; F108-L136 HydrophobicContact CD1-CD1 4.15Å; F108-L136 HydrophobicContact CD1-CG 4.41Å; F108-L136 HydrophobicContact CE1-CB 3.99Å; F108-L136 HydrophobicContact CE1-CD1 4.01Å; F108-L136 HydrophobicContact CE2-CD1 4.39Å; F108-L136 HydrophobicContact CG-CD1 4.39Å; F108-L136 HydrophobicContact CZ-CD1 4.12Å; F108-Y154 HydrophobicContact CB-CE1 4.25Å; F108-Y154 AromaticContact CD2-CD1 3.54Å; F108-Y154 HydrophobicContact CD2-CD1 3.54Å; F108-Y154 AromaticContact CD2-CE1 3.67Å; F108-Y154 HydrophobicContact CD2-CE1 3.67Å; F108-Y154 AromaticContact CE2-CD1 3.74Å; F108-Y154 HydrophobicContact CE2-CD1 3.74Å; F108-Y154 HydrophobicContact CE2-CE1 4.32Å; F108-Y154 HydrophobicContact CG-CD1 4.32Å; F108-Y154 HydrophobicContact CG-CE1 4.07Å; F108-P155 HydrophobicContact CE2-CG 4.04Å; F108-P155 HydrophobicContact CZ-CG 3.84Å; F108-W159 AromaticContact CD2-CH2 3.89Å; F108-W159 HydrophobicContact CD2-CH2 3.89Å; F108-W159 HydrophobicContact CD2-CZ2 4.08Å; F108-W159 HydrophobicContact CD2-CZ3 4.42Å; F108-W159 HydrophobicContact CE2-CH2 4.09Å; F108-W159 AromaticContact CE2-CZ2 3.81Å; F108-W159 HydrophobicContact CE2-CZ2 3.81Å
109	T	91.7	Very high	93.6	Very high	68 Å²	68	39 Å²	39	42%	0.417	21%	0.205	S	C	.	.			trans	-113.9	151.1	-177.7	62.9	0	0	0	0	113	R105 S106 H107	R105-T109 WeakPolarHBondContact CB-O 3.48Å; S106-T109 PolarHBondContact O-N 2.95Å; S106-T109 PolarHBondContact O-OG1 3.38Å; H107-T109 VanDerWaalsContact C-N 3.34Å; H107-T109 WeakPolarHBondContact O-CG2 3.03Å; H107-T109 PolarHBondContact O-N 2.52Å
110	G	93	Very high	93.6	Very high	41 Å²	41	40.2 Å²	40.2	42%	0.423	22%	0.216	S	C	.	.	S	Bend	trans	81.8	-157.2	173.9	0	0	0	0	0	114.4
111	P	95	Very high	93.6	Very high	52 Å²	52	40.4 Å²	40.4	34%	0.338	22%	0.217	S	C	.	.			trans	-61.9	143	-179.9	-19.2	31.7	0	0	0	111.6	E104 I208	E104-P111 PolarHBondContact N-O 3.1Å; P111-I208 HydrophobicContact CB-CG2 3.8Å
112	Y	97.1	Very high	93.4	Very high	22 Å²	22	44.2 Å²	44.2	9%	0.086	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	153.8	176	65.7	-89.5	0	0	0	112.7	L101 I102 Y103 L114 L203 N206 S207 I208	L101-Y112 HydrophobicContact CB-CD2 4.27Å; L101-Y112 HydrophobicContact CD2-CD2 4.07Å; L101-Y112 HydrophobicContact CD2-CE2 3.95Å; L101-Y112 HydrophobicContact CG-CD2 3.97Å; L101-Y112 HydrophobicContact CG-CE2 4.11Å; I102-Y112 CarbonylContact O-C 3.56Å; I102-Y112 WeakPolarHBondContact O-CA 3Å; I102-Y112 VanDerWaalsContact O-CB 3.25Å; I102-Y112 WeakPolarHBondContact O-CB 3.31Å; Y103-Y112 HydrophobicContact CD1-CD1 4.26Å; Y103-Y112 HydrophobicContact CD1-CG 4.33Å; Y103-Y112 AromaticContact CE1-CD1 3.63Å; Y103-Y112 HydrophobicContact CE1-CD1 3.63Å; Y103-Y112 AromaticContact CE1-CG 3.94Å; Y103-Y112 HydrophobicContact CE1-CG 3.94Å; Y112-L114 HydrophobicContact CE2-CB 4.46Å; Y112-L203 WeakPolarHBondContact OH-CA 3.44Å; Y112-L203 PolarHBondContact OH-O 3.37Å; Y112-L203 VanDerWaalsContact OH-O 3.04Å; Y112-N206 HydrophobicContact CE1-CB 4.42Å; Y112-N206 VanDerWaalsContact OH-CB 3.3Å; Y112-N206 WeakPolarHBondContact OH-CB 3.44Å; Y112-S207 WeakPolarHBondContact O-CA 3.26Å; Y112-I208 WeakPolarHBondContact O-CG1 3.48Å; Y112-I208 PolarHBondContact O-N 3.4Å
113	I	96.9	Very high	93.3	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	136.5	168.4	-67.7	175.4	0	0	0	108	L101 I102 L115 I121 I124 Y127 F129 I208 N209	L101-I113 WeakPolarHBondContact CA-O 3.27Å; I102-I113 HydrophobicContact CB-CB 4.35Å; I102-I113 HydrophobicContact CD1-CG2 4.5Å; I102-I113 PolarHBondContact N-O 3.34Å; I102-I113 PolarHBondContact O-N 2.87Å; I113-L115 HydrophobicContact CG2-CG 4.16Å; I113-I121 HydrophobicContact CD1-CD1 4.21Å; I113-I121 HydrophobicContact CG2-CD1 3.23Å; I113-I124 HydrophobicContact CD1-CB 4.43Å; I113-I124 HydrophobicContact CD1-CG2 4.37Å; I113-Y127 HydrophobicContact CD1-CD2 4.23Å; I113-F129 HydrophobicContact CD1-CB 4.19Å; I113-F129 HydrophobicContact CD1-CD1 3.79Å; I113-F129 HydrophobicContact CD1-CD2 4.25Å; I113-F129 HydrophobicContact CD1-CE1 4.11Å; I113-F129 HydrophobicContact CD1-CG 3.84Å; I113-F129 HydrophobicContact CD1-CZ 4.44Å; I113-F129 HydrophobicContact CG1-CD2 4.26Å; I113-F129 HydrophobicContact CG1-CE2 4.24Å; I113-F129 HydrophobicContact CG1-CG 4.35Å; I113-F129 HydrophobicContact CG1-CZ 4.39Å; I113-I208 HydrophobicContact CD1-CD1 4.18Å; I113-I208 HydrophobicContact CG1-CD1 3.51Å; I113-I208 HydrophobicContact CG1-CG1 3.57Å; I113-N209 HydrophobicContact CG2-CB 4.4Å
114	L	96.6	Very high	93.2	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.063	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.2	171.3	177.6	65.6	0	0	0	109.9	W100 L101 Y112 L200 L203 Q204 N209	W100-L114 WeakPolarHBondContact O-CA 3.45Å; L101-L114 HydrophobicContact CD1-CD1 3.54Å; L101-L114 HydrophobicContact CG-CD1 4.05Å; Y112-L114 HydrophobicContact CE2-CB 4.46Å; L114-L200 HydrophobicContact CD2-CD1 4.08Å; L114-L203 HydrophobicContact CD2-CB 4.18Å; L114-Q204 HydrophobicContact CD2-CB 4.16Å; L114-Q204 HydrophobicContact CD2-CG 3.37Å; L114-N209 PolarHBondContact N-OD1 3.38Å; L114-N209 VanDerWaalsContact N-OD1 3.08Å; L114-N209 PolarHBondContact O-ND2 3.32Å
115	L	94.6	Very high	93.1	Very high	4 Å²	4	50 Å²	50	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.6	173.2	-73.7	178.4	0	0	0	110.5	V53 M86 T88 Y99 W100 I102 I113 R119 I121	V53-L115 HydrophobicContact CG2-CD1 4.32Å; M86-L115 HydrophobicContact CB-CD1 4.38Å; M86-L115 HydrophobicContact CG-CD1 3.7Å; M86-L115 HydrophobicContact SD-CD1 3.56Å; M86-L115 VanDerWaalsContact SD-CD1 3.56Å; T88-L115 HydrophobicContact CG2-CB 3.76Å; T88-L115 HydrophobicContact CG2-CD1 4.09Å; Y99-L115 CarbonylContact C-O 3.43Å; Y99-L115 VanDerWaalsContact CA-O 3.32Å; Y99-L115 WeakPolarHBondContact CA-O 3.17Å; W100-L115 HydrophobicContact CB-CB 4.26Å; W100-L115 PolarHBondContact N-O 2.81Å; W100-L115 PolarHBondContact O-N 2.84Å; I102-L115 HydrophobicContact CD1-CB 4.27Å; I102-L115 HydrophobicContact CD1-CD1 3.76Å; I102-L115 HydrophobicContact CD1-CG 3.99Å; I113-L115 HydrophobicContact CG2-CG 4.16Å; L115-R119 HydrophobicContact CD2-CB 4.1Å; L115-I121 HydrophobicContact CD2-CD1 3.57Å; L115-I121 HydrophobicContact CD2-CG1 3.82Å; L115-I121 HydrophobicContact CG-CD1 4.2Å
116	G	91.8	Very high	93.2	Very high	14 Å²	14	48.3 Å²	48.3	14%	0.144	26%	0.26	C	S	.	.			trans	-84.5	-178	166.9	0	0	0	0	0	112.3	T88 R119	T88-G116 PolarHBondContact OG1-O 2.66Å; G116-R119 WeakPolarHBondContact O-CB 3.18Å
117	P	88.7	Confident	93.3	Very high	37 Å²	37	50.6 Å²	50.6	24%	0.24	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	149.9	-179.4	31.7	-40.5	0	0	0	112.3	N91 T97 R119	N91-P117 HydrophobicContact CB-CB 3.79Å; T97-P117 HydrophobicContact CG2-CB 4.12Å; T97-P117 VanDerWaalsContact CG2-CD 3.5Å; T97-P117 HydrophobicContact CG2-CG 3.45Å; T97-P117 VanDerWaalsContact CG2-CG 3.45Å; P117-R119 PolarHBondContact O-N 3.43Å; P117-R119 VanDerWaalsContact O-N 3.14Å
118	S	86.5	Confident	93.2	Very high	83 Å²	83	57 Å²	57	58%	0.58	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	28	179.1	-45.1	0	0	0	0	113.6	T88 S89 G90	T88-S118 PolarHBondContact OG1-N 3.11Å; S89-S118 PolarHBondContact O-N 3.24Å; S89-S118 VanDerWaalsContact O-N 3.09Å; G90-S118 VanDerWaalsContact CA-OG 3.25Å; G90-S118 WeakPolarHBondContact CA-OG 3.46Å
119	R	91	Very high	93	Very high	166 Å²	166	56.3 Å²	56.3	63%	0.626	29%	0.289	S	S	*	.			trans	-109.1	140.4	178.8	-64	-57.6	-173.3	169.5	0.8	111.1	C87 T88 L115 G116 P117	C87-R119 WeakPolarHBondContact CA-O 3.26Å; T88-R119 PolarHBondContact N-O 3.26Å; T88-R119 PolarHBondContact OG1-N 3.01Å; T88-R119 PolarHBondContact OG1-O 3.43Å; L115-R119 HydrophobicContact CD2-CB 4.1Å; G116-R119 WeakPolarHBondContact O-CB 3.18Å; P117-R119 PolarHBondContact O-N 3.43Å; P117-R119 VanDerWaalsContact O-N 3.14Å
120	C	93.1	Very high	92.8	Very high	48 Å²	48	59.2 Å²	59.2	32%	0.324	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148	171.5	-71.3	0	0	0	0	109.8	M86 C87	M86-C120 CarbonylContact O-C 3.59Å; M86-C120 VanDerWaalsContact O-CA 3.31Å; M86-C120 WeakPolarHBondContact O-CA 3.29Å; C87-C120 HydrophobicContact CB-CB 4.17Å; C87-C120 WeakPolarHBondContact CB-SG 3.35Å; C87-C120 WeakPolarHBondContact SG-CB 3.13Å; C87-C120 CovalentContact SG-SG 2.04Å; C87-C120 PolarHBondContact SG-SG 2.83Å
121	I	95.1	Very high	92.7	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.036	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	117.5	164	-74.1	166.7	0	0	0	106.6	S85 M86 I113 L115 I124 Y127	S85-I121 VanDerWaalsContact CA-O 3.29Å; S85-I121 WeakPolarHBondContact CA-O 3.29Å; S85-I121 WeakPolarHBondContact CB-O 3.18Å; M86-I121 HydrophobicContact CG-CB 4.08Å; M86-I121 PolarHBondContact N-O 2.82Å; M86-I121 PolarHBondContact O-N 2.85Å; M86-I121 HydrophobicContact SD-CD1 4.46Å; I113-I121 HydrophobicContact CD1-CD1 4.21Å; I113-I121 HydrophobicContact CG2-CD1 3.23Å; L115-I121 HydrophobicContact CD2-CD1 3.57Å; L115-I121 HydrophobicContact CD2-CG1 3.82Å; L115-I121 HydrophobicContact CG-CD1 4.2Å; I121-I124 HydrophobicContact CG2-CB 4.47Å; I121-I124 HydrophobicContact CG2-CG2 3.81Å; I121-Y127 HydrophobicContact CD1-CE2 3.97Å; I121-Y127 HydrophobicContact CG1-CE2 4.06Å; I121-Y127 HydrophobicContact CG2-CD2 4.33Å; I121-Y127 HydrophobicContact CG2-CE2 3.75Å
122	D	94.5	Very high	92.6	Very high	81 Å²	81	55 Å²	55	43%	0.433	27%	0.267	S	S	.	.	S	Bend	trans	-73.7	-38.8	-175.4	-61	-31.2	0	0	0	112.5	P59 N60 S85	P59-D122 CarbonylContact C-O 3.47Å; P59-D122 WeakPolarHBondContact CA-O 3.4Å; N60-D122 PolarHBondContact N-O 2.79Å; N60-D122 WeakPolarHBondContact OD1-CB 3.39Å; S85-D122 WeakPolarHBondContact CB-O 3.45Å
123	D	94.2	Very high	92.4	Very high	37 Å²	37	54.7 Å²	54.7	20%	0.198	27%	0.268	C	S	.	.			trans	-141.9	118.2	171.4	-167.5	-23.7	0	0	0	109.1	P59 Q84 R125 Q126	P59-D123 HydrophobicContact CB-CB 4.23Å; Q84-D123 CarbonylContact O-C 3.56Å; Q84-D123 WeakPolarHBondContact O-CA 3.36Å; D123-R125 PolarHBondContact O-N 2.97Å; D123-R125 WeakPolarHBondContact OD1-CB 3.4Å; D123-R125 WeakPolarHBondContact OD1-CG 3.33Å; D123-R125 PolarHBondContact OD1-N 3.34Å; D123-R125 IonicContact OD1-NE 3.11Å; D123-R125 PolarHBondContact OD1-NE 2.82Å; D123-R125 VanDerWaalsContact OD1-NE 3.11Å; D123-R125 IonicContact OD1-NH2 3.99Å; D123-R125 IonicContact OD2-CZ 3.44Å; D123-R125 IonicContact OD2-NE 3.21Å; D123-R125 PolarHBondContact OD2-NE 2.8Å; D123-R125 IonicContact OD2-NH2 2.8Å; D123-R125 PolarHBondContact OD2-NH2 2.82Å; D123-Q126 VanDerWaalsContact O-CD 3.24Å; D123-Q126 WeakPolarHBondContact O-CG 3.24Å; D123-Q126 PolarHBondContact O-NE2 3.14Å
124	I	93.4	Very high	92.3	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-69.3	-23.6	178.5	66.7	175.3	0	0	0	112.1	A83 Q84 M86 I113 I121 Q126 Y127 F129	A83-I124 WeakPolarHBondContact O-CD1 3.37Å; Q84-I124 PolarHBondContact O-N 2.95Å; M86-I124 HydrophobicContact CE-CG2 3.6Å; M86-I124 HydrophobicContact CG-CG2 4.31Å; M86-I124 HydrophobicContact SD-CG2 4.37Å; I113-I124 HydrophobicContact CD1-CB 4.43Å; I113-I124 HydrophobicContact CD1-CG2 4.37Å; I121-I124 HydrophobicContact CG2-CB 4.47Å; I121-I124 HydrophobicContact CG2-CG2 3.81Å; I124-Q126 PolarHBondContact O-N 2.86Å; I124-Y127 PolarHBondContact O-N 2.99Å; I124-F129 HydrophobicContact CB-CB 4.46Å; I124-F129 HydrophobicContact CD1-CD1 4.23Å
125	R	91.2	Very high	92.3	Very high	140 Å²	140	54.1 Å²	54.1	53%	0.528	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-67.7	-20.8	-177.2	-60.4	177.2	-64.8	-178.2	1	111.9	D123 Y127 K128	D123-R125 PolarHBondContact O-N 2.97Å; D123-R125 WeakPolarHBondContact OD1-CB 3.4Å; D123-R125 WeakPolarHBondContact OD1-CG 3.33Å; D123-R125 PolarHBondContact OD1-N 3.34Å; D123-R125 IonicContact OD1-NE 3.11Å; D123-R125 PolarHBondContact OD1-NE 2.82Å; D123-R125 VanDerWaalsContact OD1-NE 3.11Å; D123-R125 IonicContact OD1-NH2 3.99Å; D123-R125 IonicContact OD2-CZ 3.44Å; D123-R125 IonicContact OD2-NE 3.21Å; D123-R125 PolarHBondContact OD2-NE 2.8Å; D123-R125 IonicContact OD2-NH2 2.8Å; D123-R125 PolarHBondContact OD2-NH2 2.82Å; R125-Y127 PolarHBondContact O-N 3.38Å; R125-K128 PolarHBondContact O-N 3.09Å
126	Q	94.1	Very high	92.3	Very high	115 Å²	115	53.9 Å²	53.9	54%	0.537	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-58.7	-27.6	172.1	80.8	-168.2	-39.5	0	0	112.1	D123 I124 K128	D123-Q126 VanDerWaalsContact O-CD 3.24Å; D123-Q126 WeakPolarHBondContact O-CG 3.24Å; D123-Q126 PolarHBondContact O-NE2 3.14Å; I124-Q126 PolarHBondContact O-N 2.86Å; Q126-K128 VanDerWaalsContact C-N 3.35Å
127	Y	93.8	Very high	92.4	Very high	68 Å²	68	53.6 Å²	53.6	27%	0.267	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-93.6	10.5	176.4	-52.7	-66.2	0	0	0	113.2	I113 I121 I124 R125 F129 N209	I113-Y127 HydrophobicContact CD1-CD2 4.23Å; I121-Y127 HydrophobicContact CD1-CE2 3.97Å; I121-Y127 HydrophobicContact CG1-CE2 4.06Å; I121-Y127 HydrophobicContact CG2-CD2 4.33Å; I121-Y127 HydrophobicContact CG2-CE2 3.75Å; I124-Y127 PolarHBondContact O-N 2.99Å; R125-Y127 PolarHBondContact O-N 3.38Å; Y127-F129 PolarHBondContact O-N 3.38Å; Y127-F129 VanDerWaalsContact O-N 3.15Å; Y127-N209 HydrophobicContact CD1-CB 3.92Å; Y127-N209 HydrophobicContact CD2-CB 4.31Å; Y127-N209 HydrophobicContact CE1-CB 3.61Å; Y127-N209 HydrophobicContact CE2-CB 4.02Å; Y127-N209 HydrophobicContact CG-CB 4.26Å
128	K	91.3	Very high	92.6	Very high	180 Å²	180	51.8 Å²	51.8	78%	0.783	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	25.8	-173.3	-55.1	177.6	-179	175.1	0	113.5	R125 Q126	R125-K128 PolarHBondContact O-N 3.09Å; Q126-K128 VanDerWaalsContact C-N 3.35Å
129	F	89.7	Confident	92.8	Very high	3 Å²	3	48.9 Å²	48.9	1%	0.013	23%	0.225	C	C	.	.			trans	-80.8	116.7	178.9	-156.3	-113.5	0	0	0	109	I102 Y103 E104 I113 I124 Y127 A131 I208	I102-F129 HydrophobicContact CG2-CE1 3.9Å; I102-F129 HydrophobicContact CG2-CZ 4.15Å; I102-F129 WeakPolarHBondContact O-CZ 3.42Å; Y103-F129 VanDerWaalsContact C-CZ 3.45Å; E104-F129 HydrophobicContact CB-CD2 4.13Å; E104-F129 HydrophobicContact CB-CE2 3.61Å; E104-F129 HydrophobicContact CB-CZ 3.95Å; E104-F129 HydrophobicContact CG-CE2 4.44Å; E104-F129 VanDerWaalsContact N-CZ 3.29Å; I113-F129 HydrophobicContact CD1-CB 4.19Å; I113-F129 HydrophobicContact CD1-CD1 3.79Å; I113-F129 HydrophobicContact CD1-CD2 4.25Å; I113-F129 HydrophobicContact CD1-CE1 4.11Å; I113-F129 HydrophobicContact CD1-CG 3.84Å; I113-F129 HydrophobicContact CD1-CZ 4.44Å; I113-F129 HydrophobicContact CG1-CD2 4.26Å; I113-F129 HydrophobicContact CG1-CE2 4.24Å; I113-F129 HydrophobicContact CG1-CG 4.35Å; I113-F129 HydrophobicContact CG1-CZ 4.39Å; I124-F129 HydrophobicContact CB-CB 4.46Å; I124-F129 HydrophobicContact CD1-CD1 4.23Å; Y127-F129 PolarHBondContact O-N 3.38Å; Y127-F129 VanDerWaalsContact O-N 3.15Å; F129-A131 VanDerWaalsContact CD1-O 3.31Å; F129-A131 WeakPolarHBondContact CD1-O 3.38Å; F129-A131 WeakPolarHBondContact CE1-O 3.32Å; F129-I208 HydrophobicContact CB-CD1 4.03Å; F129-I208 HydrophobicContact CD2-CD1 3.17Å; F129-I208 HydrophobicContact CE2-CD1 3.77Å; F129-I208 HydrophobicContact CG-CD1 3.9Å
130	L	87.5	Confident	92.8	Very high	130 Å²	130	41.6 Å²	41.6	68%	0.681	20%	0.199	S	C	*	.			trans	-91.3	-25	-170.1	-59.5	175.7	0	0	0	113.5	E104	E104-L130 VanDerWaalsContact OE1-CB 3.3Å; E104-L130 WeakPolarHBondContact OE1-CB 3.36Å; E104-L130 WeakPolarHBondContact OE1-CG 3.5Å; E104-L130 PolarHBondContact OE1-N 3.17Å
131	A	90.8	Very high	92.5	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.025	20%	0.2	C	C	.	.			trans	-151.2	151.5	-173.2	0	0	0	0	0	111.1	V80 W81 E104 F129	V80-A131 HydrophobicContact CG1-CB 3.86Å; V80-A131 CarbonylContact O-C 3.49Å; V80-A131 VanDerWaalsContact O-CA 3.27Å; V80-A131 WeakPolarHBondContact O-CA 3.43Å; W81-A131 HydrophobicContact CD2-CB 4.44Å; W81-A131 HydrophobicContact CE3-CB 3.78Å; W81-A131 HydrophobicContact CH2-CB 4.13Å; W81-A131 HydrophobicContact CZ3-CB 3.62Å; E104-A131 WeakPolarHBondContact CA-O 3.25Å; E104-A131 HydrophobicContact CG-CB 4.42Å; F129-A131 VanDerWaalsContact CD1-O 3.31Å; F129-A131 WeakPolarHBondContact CD1-O 3.38Å; F129-A131 WeakPolarHBondContact CE1-O 3.32Å
132	T	92.4	Very high	92.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.218	C	C	.	.			trans	-111.4	92.3	169.1	-62.8	0	0	0	0	108.2	L55 L75 V80 I102 I135	L55-T132 HydrophobicContact CD2-CG2 3.56Å; L75-T132 HydrophobicContact CD1-CG2 3.67Å; L75-T132 WeakPolarHBondContact CD1-O 3.2Å; V80-T132 WeakPolarHBondContact CA-O 3.4Å; V80-T132 PolarHBondContact O-N 2.79Å; I102-T132 HydrophobicContact CG2-CG2 3.33Å; T132-I135 HydrophobicContact CG2-CD1 3.84Å; T132-I135 HydrophobicContact CG2-CG1 4.05Å
133	T	93.5	Very high	91.6	Very high	16 Å²	16	49.5 Å²	49.5	10%	0.098	23%	0.227	C	C	.	.			trans	-100.9	-35.1	-168.4	-54.6	0	0	0	0	113	L74 L75 V80 Y103 E104 S106	L74-T133 CarbonylContact C-O 3.54Å; L74-T133 VanDerWaalsContact CA-O 3.3Å; L74-T133 WeakPolarHBondContact CA-O 3.17Å; L74-T133 HydrophobicContact CD1-CG2 3.61Å; L75-T133 PolarHBondContact N-O 2.71Å; V80-T133 WeakPolarHBondContact CG1-OG1 3.3Å; Y103-T133 PolarHBondContact O-N 2.85Å; E104-T133 WeakPolarHBondContact O-CB 3.21Å; E104-T133 PolarHBondContact O-OG1 2.98Å; S106-T133 VanDerWaalsContact N-CG2 3.34Å
134	S	94.7	Very high	90.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.2	173	63.6	0	0	0	0	111.2	N72 E73 Y103 R105 F108	N72-S134 WeakPolarHBondContact O-CA 3.21Å; N72-S134 WeakPolarHBondContact O-CB 3.5Å; E73-S134 VanDerWaalsContact O-CB 3.27Å; E73-S134 WeakPolarHBondContact O-CB 3.49Å; Y103-S134 WeakPolarHBondContact CB-OG 3.48Å; Y103-S134 PolarHBondContact N-O 3.4Å; Y103-S134 PolarHBondContact O-N 2.9Å; R105-S134 WeakPolarHBondContact O-CB 3.34Å; R105-S134 PolarHBondContact O-OG 2.95Å; F108-S134 PolarHBondContact N-OG 3.24Å
135	I	95.6	Very high	90.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.3	-175.3	-62.3	-168.8	0	0	0	109.3	V53 L55 I68 S71 N72 L75 W100 L101 I102 F108 T132	V53-I135 HydrophobicContact CG1-CD1 4.27Å; V53-I135 HydrophobicContact CG1-CG2 4.24Å; L55-I135 HydrophobicContact CD1-CD1 4.05Å; L55-I135 HydrophobicContact CD2-CD1 4Å; I68-I135 HydrophobicContact CD1-CD1 3.59Å; I68-I135 HydrophobicContact CG2-CG2 4.39Å; S71-I135 CarbonylContact C-O 3.49Å; S71-I135 VanDerWaalsContact CA-O 3.24Å; S71-I135 WeakPolarHBondContact CA-O 3.41Å; N72-I135 PolarHBondContact N-O 3.08Å; N72-I135 PolarHBondContact O-N 3.27Å; L75-I135 HydrophobicContact CD1-CD1 3.92Å; L75-I135 HydrophobicContact CD1-CG1 4.14Å; L75-I135 HydrophobicContact CD2-CG1 4.38Å; W100-I135 HydrophobicContact CD2-CG2 4.44Å; W100-I135 HydrophobicContact CE3-CG2 3.28Å; W100-I135 HydrophobicContact CZ3-CG2 3.5Å; L101-I135 CarbonylContact O-C 3.53Å; L101-I135 WeakPolarHBondContact O-CA 3.37Å; I102-I135 HydrophobicContact CG1-CD1 4.17Å; I102-I135 HydrophobicContact CG1-CG1 4.22Å; I102-I135 HydrophobicContact CG1-CG2 4.43Å; I102-I135 HydrophobicContact CG2-CD1 4.39Å; I102-I135 HydrophobicContact CG2-CG1 4.18Å; F108-I135 WeakPolarHBondContact CE1-O 3.06Å; T132-I135 HydrophobicContact CG2-CD1 3.84Å; T132-I135 HydrophobicContact CG2-CG1 4.05Å
136	L	95.3	Very high	90	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.1	-177.8	-172.1	70.8	0	0	0	110	L101 Y103 F108 C152 Q153 Y154	L101-L136 HydrophobicContact CB-CB 4.3Å; L101-L136 PolarHBondContact N-O 3.06Å; L101-L136 PolarHBondContact O-N 2.93Å; Y103-L136 HydrophobicContact CE2-CB 4.2Å; Y103-L136 HydrophobicContact CE2-CD2 4.46Å; F108-L136 HydrophobicContact CD1-CB 3.77Å; F108-L136 HydrophobicContact CD1-CD1 4.15Å; F108-L136 HydrophobicContact CD1-CG 4.41Å; F108-L136 HydrophobicContact CE1-CB 3.99Å; F108-L136 HydrophobicContact CE1-CD1 4.01Å; F108-L136 HydrophobicContact CE2-CD1 4.39Å; F108-L136 HydrophobicContact CG-CD1 4.39Å; F108-L136 HydrophobicContact CZ-CD1 4.12Å; L136-C152 HydrophobicContact CD1-CB 4.43Å; L136-C152 HydrophobicContact CD2-CB 3.66Å; L136-C152 HydrophobicContact CG-CB 3.98Å; L136-Q153 WeakPolarHBondContact CD1-O 3.41Å; L136-Y154 HydrophobicContact CD1-CD1 3.71Å; L136-Y154 HydrophobicContact CD1-CD2 4.38Å; L136-Y154 HydrophobicContact CD1-CE1 3.83Å; L136-Y154 HydrophobicContact CD1-CE2 4.48Å; L136-Y154 HydrophobicContact CD1-CG 4.01Å; L136-Y154 HydrophobicContact CD2-CD1 4.45Å; L136-Y154 HydrophobicContact CD2-CE1 3.72Å; L136-Y154 HydrophobicContact CD2-CE2 4.25Å; L136-Y154 HydrophobicContact CG-CE1 4.47Å
137	I	93.5	Very high	89.8	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.036	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	133.9	171.9	-162.5	177.6	0	0	0	110	S71 I98 W100 C152 Q153	S71-I137 WeakPolarHBondContact OG-CG2 3.08Å; S71-I137 PolarHBondContact OG-N 3.47Å; I98-I137 HydrophobicContact CG2-CD1 3.72Å; I98-I137 HydrophobicContact CG2-CG1 3.56Å; W100-I137 HydrophobicContact CD2-CB 4.43Å; W100-I137 HydrophobicContact CD2-CG1 4.27Å; W100-I137 HydrophobicContact CE3-CB 4Å; W100-I137 HydrophobicContact CE3-CG1 4.33Å; W100-I137 HydrophobicContact CH2-CB 3.89Å; W100-I137 HydrophobicContact CH2-CD1 3.94Å; W100-I137 HydrophobicContact CH2-CG1 4.04Å; W100-I137 HydrophobicContact CZ2-CB 4.28Å; W100-I137 HydrophobicContact CZ2-CD1 3.69Å; W100-I137 HydrophobicContact CZ2-CG1 3.91Å; W100-I137 HydrophobicContact CZ3-CB 3.73Å; W100-I137 HydrophobicContact CZ3-CG1 4.24Å; I137-C152 WeakPolarHBondContact O-CA 3.35Å; I137-Q153 HydrophobicContact CG2-CB 3.83Å; I137-Q153 HydrophobicContact CG2-CG 4.16Å; I137-Q153 PolarHBondContact O-N 2.98Å
138	C	93	Very high	89.7	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134.6	173.7	-51.6	0	0	0	0	110.2	Y99 L101 V150 S151 C152	Y99-C138 PolarHBondContact N-O 3.48Å; Y99-C138 PolarHBondContact O-N 2.91Å; L101-C138 HydrophobicContact CD1-CB 4.36Å; L101-C138 WeakPolarHBondContact CD1-SG 3.16Å; C138-V150 HydrophobicContact CB-CB 4.14Å; C138-V150 HydrophobicContact CB-CG2 4.05Å; C138-S151 CarbonylContact C-O 3.54Å; C138-S151 VanDerWaalsContact CA-O 3.31Å; C138-S151 WeakPolarHBondContact CA-O 3.23Å; C138-C152 HydrophobicContact CB-CB 4.07Å; C138-C152 WeakPolarHBondContact CB-SG 3.4Å; C138-C152 WeakPolarHBondContact SG-CB 3.27Å; C138-C152 CovalentContact SG-SG 2.04Å; C138-C152 PolarHBondContact SG-SG 2.03Å
139	V	90.8	Very high	89.8	Confident	21 Å²	21	50.2 Å²	50.2	13%	0.127	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.8	-175.4	-175.8	0	0	0	0	109.3	R96 I141 V150 S151	R96-V139 HydrophobicContact CB-CG1 3.88Å; R96-V139 HydrophobicContact CG-CG1 4.48Å; V139-I141 PolarHBondContact O-N 2.88Å; V139-V150 CarbonylContact O-C 3.5Å; V139-V150 VanDerWaalsContact O-CA 3.31Å; V139-V150 WeakPolarHBondContact O-CA 3.37Å; V139-S151 PolarHBondContact N-O 3.46Å; V139-S151 PolarHBondContact O-N 2.81Å
140	E	90.5	Very high	90	Very high	14 Å²	14	50 Å²	50	7%	0.065	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	126.3	172.2	177.5	166.4	-179.3	0	0	111.3	T97 Y99 R143 V148	T97-E140 WeakPolarHBondContact CB-OE2 3.14Å; T97-E140 WeakPolarHBondContact O-CB 3.31Å; T97-E140 PolarHBondContact O-N 2.82Å; T97-E140 PolarHBondContact OG1-OE2 2.9Å; Y99-E140 HydrophobicContact CE2-CB 4.39Å; E140-R143 VanDerWaalsContact CD-NH2 3.31Å; E140-R143 WeakPolarHBondContact OE1-CB 3.37Å; E140-R143 IonicContact OE1-CZ 3.21Å; E140-R143 IonicContact OE1-NE 3.29Å; E140-R143 PolarHBondContact OE1-NE 2.83Å; E140-R143 IonicContact OE1-NH2 3.03Å; E140-R143 PolarHBondContact OE1-NH2 3.48Å; E140-R143 IonicContact OE2-CZ 3.73Å; E140-R143 IonicContact OE2-NE 2.84Å; E140-R143 IonicContact OE2-NH2 2.77Å; E140-R143 PolarHBondContact OE2-NH2 3.26Å; E140-V148 HydrophobicContact CB-CG1 4.14Å; E140-V148 HydrophobicContact CG-CG1 3.48Å; E140-V148 VanDerWaalsContact CG-CG1 3.48Å
141	I	88.7	Confident	90.3	Very high	70 Å²	70	45 Å²	45	36%	0.359	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-48.3	174.7	-57.7	-170.2	0	0	0	110.5	V139 L149 M197	V139-I141 PolarHBondContact O-N 2.88Å; I141-L149 PolarHBondContact N-O 2.59Å; I141-M197 HydrophobicContact CD1-CE 4.04Å; I141-M197 HydrophobicContact CG2-CE 4.28Å
142	V	86.5	Confident	90.4	Very high	66 Å²	66	45.1 Å²	45.1	40%	0.4	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	127.4	-173.9	-174.9	0	0	0	0	109.7	L149	V142-L149 HydrophobicContact CB-CB 4.26Å; V142-L149 HydrophobicContact CB-CD1 4.38Å; V142-L149 PolarHBondContact N-O 2.92Å; V142-L149 PolarHBondContact O-N 2.8Å
143	R	83.9	Confident	90.5	Very high	165 Å²	165	50 Å²	50	62%	0.623	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	103.8	167.2	-166.9	165.3	-70.2	175.7	-2.5	109.3	E140 V148	E140-R143 VanDerWaalsContact CD-NH2 3.31Å; E140-R143 WeakPolarHBondContact OE1-CB 3.37Å; E140-R143 IonicContact OE1-CZ 3.21Å; E140-R143 IonicContact OE1-NE 3.29Å; E140-R143 PolarHBondContact OE1-NE 2.83Å; E140-R143 IonicContact OE1-NH2 3.03Å; E140-R143 PolarHBondContact OE1-NH2 3.48Å; E140-R143 IonicContact OE2-CZ 3.73Å; E140-R143 IonicContact OE2-NE 2.84Å; E140-R143 IonicContact OE2-NH2 2.77Å; E140-R143 PolarHBondContact OE2-NH2 3.26Å; R143-V148 HydrophobicContact CG-CG2 4.23Å
144	A	79.6	Confident	90.4	Very high	54 Å²	54	53.6 Å²	53.6	45%	0.446	27%	0.266	S	S	.	.			trans	-86.7	169.7	169.2	0	0	0	0	0	110	L146 D147	A144-L146 VanDerWaalsContact C-N 3.25Å; A144-L146 PolarHBondContact O-N 2.85Å; A144-D147 CarbonylContact C-O 3.5Å; A144-D147 WeakPolarHBondContact CA-O 3.31Å; A144-D147 WeakPolarHBondContact CB-O 3.06Å; A144-D147 PolarHBondContact N-O 2.89Å
145	K	79.9	Confident	90.2	Very high	217 Å²	217	55.1 Å²	55.1	94%	0.943	28%	0.275	S	S	*	.	S	Bend	trans	-61	-30.8	-177.5	-81	-174.3	177.6	180	0	114.2
146	L	85	Confident	89.8	Confident	170 Å²	170	64.6 Å²	64.6	89%	0.89	32%	0.316	S	S	*	.	S	Bend	trans	-115.4	-12.1	-173.4	-66	174.9	0	0	0	113.6	A144	A144-L146 VanDerWaalsContact C-N 3.25Å; A144-L146 PolarHBondContact O-N 2.85Å
147	D	90.8	Very high	89.3	Confident	40 Å²	40	71.5 Å²	71.5	21%	0.214	35%	0.349	C	S	.	.			trans	-156.8	159.2	-174.1	-165.2	19.7	0	0	0	111.3	A144 S199 T201	A144-D147 CarbonylContact C-O 3.5Å; A144-D147 WeakPolarHBondContact CA-O 3.31Å; A144-D147 WeakPolarHBondContact CB-O 3.06Å; A144-D147 PolarHBondContact N-O 2.89Å; D147-S199 VanDerWaalsContact CG-OG 3.29Å; D147-S199 PolarHBondContact OD1-OG 2.72Å; D147-S199 WeakPolarHBondContact OD2-CB 3.39Å; D147-S199 PolarHBondContact OD2-OG 3.1Å; D147-T201 WeakPolarHBondContact OD1-CB 3.39Å; D147-T201 PolarHBondContact OD1-N 2.04Å; D147-T201 VanDerWaalsContact OD1-N 3.11Å; D147-T201 PolarHBondContact OD1-OG1 3.28Å
148	V	91.2	Very high	88.9	Confident	21 Å²	21	76.5 Å²	76.5	13%	0.127	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.2	175.4	179.9	0	0	0	0	108	E140 R143 V150 L200	E140-V148 HydrophobicContact CB-CG1 4.14Å; E140-V148 HydrophobicContact CG-CG1 3.48Å; E140-V148 VanDerWaalsContact CG-CG1 3.48Å; R143-V148 HydrophobicContact CG-CG2 4.23Å; V148-V150 HydrophobicContact CG1-CG1 4.21Å; V148-L200 HydrophobicContact CB-CB 3.89Å; V148-L200 HydrophobicContact CB-CD2 3.83Å; V148-L200 HydrophobicContact CG1-CD2 4.26Å; V148-L200 HydrophobicContact CG2-CD2 4.21Å; V148-L200 WeakPolarHBondContact O-CB 3.36Å; V148-L200 PolarHBondContact O-N 2.79Å
149	L	92.9	Very high	88.4	Confident	57 Å²	57	79.2 Å²	79.2	30%	0.298	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.4	172	-60.8	179.6	0	0	0	109.3	I141 V142 M197 H198	I141-L149 PolarHBondContact N-O 2.59Å; V142-L149 HydrophobicContact CB-CB 4.26Å; V142-L149 HydrophobicContact CB-CD1 4.38Å; V142-L149 PolarHBondContact N-O 2.92Å; V142-L149 PolarHBondContact O-N 2.8Å; L149-M197 HydrophobicContact CD1-SD 4.43Å; L149-H198 WeakPolarHBondContact CA-O 3.17Å
150	V	93.5	Very high	87.8	Confident	0 Å²	0	84 Å²	84	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	150.9	176.3	-58.8	0	0	0	0	110	Y99 C138 V139 V148 M197 H198 L200 L203	Y99-V150 HydrophobicContact CD2-CG1 3.81Å; Y99-V150 HydrophobicContact CE2-CG1 4Å; C138-V150 HydrophobicContact CB-CB 4.14Å; C138-V150 HydrophobicContact CB-CG2 4.05Å; V139-V150 CarbonylContact O-C 3.5Å; V139-V150 VanDerWaalsContact O-CA 3.31Å; V139-V150 WeakPolarHBondContact O-CA 3.37Å; V148-V150 HydrophobicContact CG1-CG1 4.21Å; V150-M197 CarbonylContact O-C 3.56Å; V150-M197 WeakPolarHBondContact O-CA 3.46Å; V150-H198 HydrophobicContact CG2-CB 4.11Å; V150-H198 PolarHBondContact N-O 3.09Å; V150-H198 PolarHBondContact O-N 3.05Å; V150-L200 HydrophobicContact CG1-CB 4.33Å; V150-L200 HydrophobicContact CG1-CD1 4.42Å; V150-L203 HydrophobicContact CG2-CD1 3.6Å
151	S	94.1	Very high	86.9	Confident	23 Å²	23	90 Å²	90	16%	0.161	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.9	167.7	176.1	0	0	0	0	110	C138 V139	C138-S151 CarbonylContact C-O 3.54Å; C138-S151 VanDerWaalsContact CA-O 3.31Å; C138-S151 WeakPolarHBondContact CA-O 3.23Å; V139-S151 PolarHBondContact N-O 3.46Å; V139-S151 PolarHBondContact O-N 2.81Å
152	C	93.9	Very high	85.7	Confident	7 Å²	7	92.8 Å²	92.8	5%	0.047	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.2	-178.2	-58.6	0	0	0	0	110.8	L136 I137 C138 Y154	L136-C152 HydrophobicContact CD1-CB 4.43Å; L136-C152 HydrophobicContact CD2-CB 3.66Å; L136-C152 HydrophobicContact CG-CB 3.98Å; I137-C152 WeakPolarHBondContact O-CA 3.35Å; C138-C152 HydrophobicContact CB-CB 4.07Å; C138-C152 WeakPolarHBondContact CB-SG 3.4Å; C138-C152 WeakPolarHBondContact SG-CB 3.27Å; C138-C152 CovalentContact SG-SG 2.04Å; C138-C152 PolarHBondContact SG-SG 2.03Å; C152-Y154 HydrophobicContact CB-CD2 4.49Å; C152-Y154 HydrophobicContact CB-CE2 3.88Å; C152-Y154 PolarHBondContact O-N 3.31Å
153	Q	92.5	Very high	84	Confident	103 Å²	103	97.6 Å²	97.6	48%	0.481	46%	0.461	S	S	.	.			trans	-97	98.3	-174.6	-59.4	-178.7	4.9	0	0	109.6	S71 L136 I137	S71-Q153 WeakPolarHBondContact CB-O 3.16Å; S71-Q153 PolarHBondContact OG-O 2.86Å; L136-Q153 WeakPolarHBondContact CD1-O 3.41Å; I137-Q153 HydrophobicContact CG2-CB 3.83Å; I137-Q153 HydrophobicContact CG2-CG 4.16Å; I137-Q153 PolarHBondContact O-N 2.98Å
154	Y	92.7	Very high	82.2	Confident	91 Å²	91	98.1 Å²	98.1	36%	0.357	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-80.1	138.2	176.8	-67.2	-91.2	0	0	0	110.9	F108 L136 C152 W159	F108-Y154 HydrophobicContact CB-CE1 4.25Å; F108-Y154 AromaticContact CD2-CD1 3.54Å; F108-Y154 HydrophobicContact CD2-CD1 3.54Å; F108-Y154 AromaticContact CD2-CE1 3.67Å; F108-Y154 HydrophobicContact CD2-CE1 3.67Å; F108-Y154 AromaticContact CE2-CD1 3.74Å; F108-Y154 HydrophobicContact CE2-CD1 3.74Å; F108-Y154 HydrophobicContact CE2-CE1 4.32Å; F108-Y154 HydrophobicContact CG-CD1 4.32Å; F108-Y154 HydrophobicContact CG-CE1 4.07Å; L136-Y154 HydrophobicContact CD1-CD1 3.71Å; L136-Y154 HydrophobicContact CD1-CD2 4.38Å; L136-Y154 HydrophobicContact CD1-CE1 3.83Å; L136-Y154 HydrophobicContact CD1-CE2 4.48Å; L136-Y154 HydrophobicContact CD1-CG 4.01Å; L136-Y154 HydrophobicContact CD2-CD1 4.45Å; L136-Y154 HydrophobicContact CD2-CE1 3.72Å; L136-Y154 HydrophobicContact CD2-CE2 4.25Å; L136-Y154 HydrophobicContact CG-CE1 4.47Å; C152-Y154 HydrophobicContact CB-CD2 4.49Å; C152-Y154 HydrophobicContact CB-CE2 3.88Å; C152-Y154 PolarHBondContact O-N 3.31Å; Y154-W159 HydrophobicContact CD1-CH2 4.23Å; Y154-W159 HydrophobicContact CD1-CZ2 4.04Å
155	P	90.6	Very high	80.5	Confident	31 Å²	31	101.1 Å²	101.1	20%	0.201	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-63.6	150.4	173	24.8	-29.5	0	0	0	110.4	E73 F108 Q157 W159	E73-P155 HydrophobicContact CB-CG 4.08Å; F108-P155 HydrophobicContact CE2-CG 4.04Å; F108-P155 HydrophobicContact CZ-CG 3.84Å; P155-Q157 PolarHBondContact O-N 2.89Å; P155-W159 PolarHBondContact O-NE1 2.77Å
156	K	87.6	Confident	78.5	Confident	199 Å²	199	96.6 Å²	96.6	87%	0.865	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-59.7	137.8	-179	-68.9	-175.6	-179.7	177.9	0	110.9
157	Q	84.2	Confident	76.2	Confident	145 Å²	145	99 Å²	99	68%	0.678	47%	0.467	S	S	*	.	S	Bend	trans	-80.8	155.3	173.2	-70.2	-177.8	6.2	0	0	110.9	P155 W159	P155-Q157 PolarHBondContact O-N 2.89Å; Q157-W159 HydrophobicContact CG-CD2 4.25Å; Q157-W159 HydrophobicContact CG-CG 4.37Å; Q157-W159 HydrophobicContact CG-CZ2 4.32Å
158	P	85.3	Confident	73.7	Confident	113 Å²	113	105 Å²	105	73%	0.734	49%	0.493	S	S	*	.	S	Bend	cis	-76.6	138.1	3.9	31.6	-34.6	0	0	0	112.6
159	W	83	Confident	71.3	Confident	57 Å²	57	107.7 Å²	107.7	22%	0.216	51%	0.513	C	S	.	.	P	Polyproline II helix	trans	-71.1	157.6	168.9	-63.6	-24.1	0	0	0	110.6	E73 H107 F108 Y154 P155 Q157 Q161	E73-W159 HydrophobicContact CB-CD2 4.37Å; E73-W159 HydrophobicContact CB-CG 4.12Å; E73-W159 HydrophobicContact CG-CB 3.95Å; E73-W159 HydrophobicContact CG-CG 4.01Å; H107-W159 HydrophobicContact CB-CE3 3.81Å; H107-W159 HydrophobicContact CB-CZ3 3.93Å; H107-W159 AromaticContact CD2-CE3 3.74Å; F108-W159 AromaticContact CD2-CH2 3.89Å; F108-W159 HydrophobicContact CD2-CH2 3.89Å; F108-W159 HydrophobicContact CD2-CZ2 4.08Å; F108-W159 HydrophobicContact CD2-CZ3 4.42Å; F108-W159 HydrophobicContact CE2-CH2 4.09Å; F108-W159 AromaticContact CE2-CZ2 3.81Å; F108-W159 HydrophobicContact CE2-CZ2 3.81Å; Y154-W159 HydrophobicContact CD1-CH2 4.23Å; Y154-W159 HydrophobicContact CD1-CZ2 4.04Å; P155-W159 PolarHBondContact O-NE1 2.77Å; Q157-W159 HydrophobicContact CG-CD2 4.25Å; Q157-W159 HydrophobicContact CG-CG 4.37Å; Q157-W159 HydrophobicContact CG-CZ2 4.32Å; W159-Q161 PolarHBondContact O-N 3.42Å
160	R	78.1	Confident	68.8	Low	121 Å²	121	113 Å²	113	46%	0.457	54%	0.542	S	S	.	.			trans	-50.8	113.8	172.4	-79	178.8	-77.7	175.6	-6.5	109.1	N72 E73 L74 H107	N72-R160 PolarHBondContact OD1-NH2 3.12Å; E73-R160 IonicContact OE1-CZ 3.48Å; E73-R160 VanDerWaalsContact OE1-CZ 3.29Å; E73-R160 IonicContact OE1-NE 3.17Å; E73-R160 PolarHBondContact OE1-NE 3.36Å; E73-R160 IonicContact OE1-NH2 3.4Å; E73-R160 PolarHBondContact OE1-NH2 3.45Å; L74-R160 PolarHBondContact O-NH2 3.04Å; H107-R160 PolarHBondContact CE1-O 2.76Å; H107-R160 PolarHBondContact NE2-O 2.8Å
161	Q	71	Confident	66.4	Low	140 Å²	140	119.3 Å²	119.3	65%	0.654	58%	0.576	S	S	*	*			trans	-83.9	133.5	175.4	-66.1	-174.6	-9.8	0	0	108.3	W159 F163	W159-Q161 PolarHBondContact O-N 3.42Å; Q161-F163 PolarHBondContact O-N 3.12Å
162	F	63	Low	63.5	Low	128 Å²	128	127.6 Å²	127.6	56%	0.561	61%	0.609	S	S	*	*			trans	-80.1	115.4	171.4	-65.4	-84.5	0	0	0	108.3	L74 S106 H107	L74-F162 HydrophobicContact CD1-CZ 4.14Å; L74-F162 HydrophobicContact CD2-CE1 3.98Å; L74-F162 HydrophobicContact CD2-CZ 3.68Å; L74-F162 HydrophobicContact CG-CZ 4.49Å; S106-F162 WeakPolarHBondContact OG-CE2 3.37Å; H107-F162 AromaticContact CE1-CD2 3.69Å; H107-F162 AromaticContact CE1-CE2 3.41Å; H107-F162 VanDerWaalsContact CE1-CE2 3.41Å; H107-F162 WeakPolarHBondContact CE1-CE2 3.3Å
163	F	51.7	Low	60.7	Low	167 Å²	167	133.8 Å²	133.8	73%	0.732	65%	0.646	S	S	*	*			trans	-81.1	130.6	154.5	-47.9	-73.7	0	0	0	105.8	Q161 V165	Q161-F163 PolarHBondContact O-N 3.12Å; F163-V165 PolarHBondContact O-N 2.93Å
164	Q	46.5	Very low	57.7	Low	176 Å²	176	134.5 Å²	134.5	82%	0.822	66%	0.657	S	S	*	*			trans	-56	118	160.4	-70.8	-169	-3	0	0	105.6	N166	Q164-N166 PolarHBondContact O-N 3.35Å
165	V	43.6	Very low	54.9	Low	117 Å²	117	135.2 Å²	135.2	71%	0.709	68%	0.676	S	S	*	*			trans	-68.2	87.9	169.4	-175.4	0	0	0	0	104.4	F163 W167	F163-V165 PolarHBondContact O-N 2.93Å; V165-W167 HydrophobicContact CG1-CE3 3.99Å; V165-W167 PolarHBondContact O-N 3.16Å
166	N	38.2	Very low	52.3	Low	123 Å²	123	143 Å²	143	66%	0.658	71%	0.707	S	S	*	*			trans	-58.6	101.8	160	-82.6	-12.2	0	0	0	104.1	Q164 H168	Q164-N166 PolarHBondContact O-N 3.35Å; N166-H168 PolarHBondContact O-N 2.79Å
167	W	36	Very low	49.6	Very low	221 Å²	221	142.5 Å²	142.5	84%	0.837	71%	0.707	S	S	*	*	S	Bend	trans	-60.1	-8.2	-175.4	-168.7	-108.2	0	0	0	112.1	V165	V165-W167 HydrophobicContact CG1-CE3 3.99Å; V165-W167 PolarHBondContact O-N 3.16Å
168	H	38.6	Very low	47.2	Very low	165 Å²	165	141.3 Å²	141.3	76%	0.764	72%	0.715	S	S	*	*	S	Bend	trans	-131.9	97.4	174.4	-74.3	15.4	0	0	0	110.8	N166	N166-H168 PolarHBondContact O-N 2.79Å
169	S	40.2	Very low	44.6	Very low	78 Å²	78	142.2 Å²	142.2	55%	0.545	72%	0.718	S	S	.	*				-173.6	122.5	125.1	71.4	0	0	0	0	108.5	N171	S169-N171 PolarHBondContact O-N 3.18Å; S169-N171 PolarHBondContact OG-ND2 3.29Å
170	D	40.5	Very low	42	Very low	167 Å²	167	146 Å²	146	89%	0.893	75%	0.747	S	S	*	*			trans	-52	96.4	163.1	-71	-50.7	0	0	0	109.7
171	N	42.6	Very low	40	Very low	134 Å²	134	146.9 Å²	146.9	72%	0.717	77%	0.766	S	S	*	*			trans	-136.1	88.3	176.7	-88	-36.8	0	0	0	111.3	S169 V173	S169-N171 PolarHBondContact O-N 3.18Å; S169-N171 PolarHBondContact OG-ND2 3.29Å; N171-V173 PolarHBondContact O-N 3.08Å
172	K	32.8	Very low	38.1	Very low	197 Å²	197	143.2 Å²	143.2	86%	0.857	77%	0.766	S	S	*	*			trans	11.1	100.2	145.2	-142.4	174.3	-173.6	-178.5	0	115.6	T174	K172-T174 PolarHBondContact O-N 3Å; K172-T174 VanDerWaalsContact O-N 3.12Å
173	V	35.9	Very low	36.7	Very low	137 Å²	137	146.5 Å²	146.5	83%	0.83	79%	0.785	S	S	*	*			trans	-49.4	112	169.5	-180	0	0	0	0	110.2	N171	N171-V173 PolarHBondContact O-N 3.08Å
174	T	30.2	Very low	35.8	Very low	117 Å²	117	146.1 Å²	146.1	72%	0.718	78%	0.784	S	S	*	*			trans	-115.1	98.8	164.4	-51	0	0	0	0	107.4	K172 K176	K172-T174 PolarHBondContact O-N 3Å; K172-T174 VanDerWaalsContact O-N 3.12Å; T174-K176 PolarHBondContact O-N 3.42Å
175	S	34.2	Very low	35.2	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	77%	0.768	S	S	*	*			trans	-67.5	110.6	175.5	47.3	0	0	0	0	109.7
176	K	34.8	Very low	35.1	Very low	195 Å²	195	139.3 Å²	139.3	85%	0.848	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-92.9	120.6	164.5	-78.7	-174.7	177.1	179.2	0	109	T174	T174-K176 PolarHBondContact O-N 3.42Å
177	Q	31.9	Very low	35	Very low	188 Å²	188	139.8 Å²	139.8	88%	0.879	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-53.8	133.9	-179.5	-77	160.6	-30.9	0	0	112.1
178	S	32.6	Very low	35.2	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-67.1	125.1	172	50.7	0	0	0	0	111
179	V	30.3	Very low	35.4	Very low	132 Å²	132	130.3 Å²	130.3	80%	0.8	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-72.2	139.4	176.4	173.4	0	0	0	0	110.8
180	T	29.2	Very low	35.1	Very low	136 Å²	136	134.2 Å²	134.2	83%	0.834	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-55.4	125.7	-177.2	-37.9	0	0	0	0	113.4
181	V	36.3	Very low	34.8	Very low	140 Å²	140	129.1 Å²	129.1	85%	0.848	73%	0.727	S	S	*	*			trans	-86.7	114	175.9	177.5	0	0	0	0	109.4
182	G	31.9	Very low	34.9	Very low	63 Å²	63	125.2 Å²	125.2	65%	0.649	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-71.9	143.1	176.1	0	0	0	0	0	113.2	K184	G182-K184 PolarHBondContact O-N 2.92Å
183	M	32.7	Very low	35.6	Very low	197 Å²	197	118 Å²	118	97%	0.97	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-63.6	121.6	174.5	-80.4	161.9	71.4	0	0	110.9
184	K	32.8	Very low	36	Very low	160 Å²	160	118 Å²	118	70%	0.696	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-89.3	143.2	169.9	-78.8	-177.1	163.1	-128.9	0	111.1	G182 E188	G182-K184 PolarHBondContact O-N 2.92Å; K184-E188 VanDerWaalsContact CD-OE2 3.29Å; K184-E188 WeakPolarHBondContact CD-OE2 3.04Å; K184-E188 WeakPolarHBondContact CE-OE2 3.09Å; K184-E188 IonicContact NZ-OE2 2.79Å; K184-E188 PolarHBondContact NZ-OE2 3.32Å
185	S	33.1	Very low	37.3	Very low	70 Å²	70	120.3 Å²	120.3	49%	0.49	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-75.3	159.7	-177.4	82.5	0	0	0	0	112.5	D187 E188	S185-D187 VanDerWaalsContact C-N 3.26Å; S185-D187 PolarHBondContact O-N 2.84Å; S185-E188 PolarHBondContact O-N 3.29Å
186	A	43.4	Very low	39	Very low	79 Å²	79	118.3 Å²	118.3	65%	0.653	66%	0.661	S	S	*	*	H	α-helix	trans	-63	-24.7	-173.5	0	0	0	0	0	114.7	V189	A186-V189 PolarHBondContact O-N 3.12Å
187	D	34.2	Very low	41.4	Very low	134 Å²	134	111.7 Å²	111.7	72%	0.717	63%	0.634	S	S	*	*	H	α-helix	trans	-76.9	-33.9	-178.3	-68.1	-39	0	0	0	112.6	S185 V189 K190 A191	S185-D187 VanDerWaalsContact C-N 3.26Å; S185-D187 PolarHBondContact O-N 2.84Å; D187-V189 VanDerWaalsContact C-N 3.25Å; D187-V189 PolarHBondContact O-N 3.02Å; D187-K190 PolarHBondContact O-N 2.73Å; D187-A191 PolarHBondContact O-N 3.17Å
188	E	41.3	Very low	44.2	Very low	96 Å²	96	105.4 Å²	105.4	45%	0.449	60%	0.604	S	S	.	*	H	α-helix	trans	-66.9	-27.8	172.2	-76.8	-170.8	-176.7	0	0	112.3	K184 S185 K190 S192	K184-E188 VanDerWaalsContact CD-OE2 3.29Å; K184-E188 WeakPolarHBondContact CD-OE2 3.04Å; K184-E188 WeakPolarHBondContact CE-OE2 3.09Å; K184-E188 IonicContact NZ-OE2 2.79Å; K184-E188 PolarHBondContact NZ-OE2 3.32Å; S185-E188 PolarHBondContact O-N 3.29Å; E188-K190 VanDerWaalsContact C-N 3.3Å; E188-K190 PolarHBondContact O-N 3.48Å; E188-S192 WeakPolarHBondContact O-CB 3.41Å; E188-S192 PolarHBondContact O-N 2.91Å; E188-S192 PolarHBondContact O-OG 3.35Å
189	V	43.2	Very low	47.1	Very low	90 Å²	90	100.9 Å²	100.9	55%	0.545	57%	0.573	S	S	.	*	H	α-helix	trans	-67	-35	177	-178.6	0	0	0	0	110.8	A186 D187 S192 S193	A186-V189 PolarHBondContact O-N 3.12Å; D187-V189 VanDerWaalsContact C-N 3.25Å; D187-V189 PolarHBondContact O-N 3.02Å; V189-S192 PolarHBondContact O-OG 2.87Å; V189-S193 WeakPolarHBondContact O-CB 3.25Å; V189-S193 PolarHBondContact O-N 2.71Å; V189-S193 VanDerWaalsContact O-N 3.16Å
190	K	33.3	Very low	50.2	Low	161 Å²	161	95 Å²	95	70%	0.7	54%	0.537	S	S	*	.	H	α-helix	trans	-78.5	-40.1	-179	-153.2	174.7	-176.1	-178.9	0	112	D187 E188 S193 M194	D187-K190 PolarHBondContact O-N 2.73Å; E188-K190 VanDerWaalsContact C-N 3.3Å; E188-K190 PolarHBondContact O-N 3.48Å; K190-S193 WeakPolarHBondContact O-CB 3.01Å; K190-S193 PolarHBondContact O-N 3.48Å; K190-S193 PolarHBondContact O-OG 2.89Å; K190-M194 PolarHBondContact O-N 2.77Å
191	A	34.8	Very low	53.3	Low	60 Å²	60	92 Å²	92	50%	0.496	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-44.9	174.6	0	0	0	0	0	112.1	D187 S193 M194 E195	D187-A191 PolarHBondContact O-N 3.17Å; A191-S193 PolarHBondContact O-N 3.32Å; A191-M194 PolarHBondContact O-N 3.47Å; A191-M194 VanDerWaalsContact O-N 3.12Å; A191-E195 PolarHBondContact O-N 2.92Å
192	S	44.3	Very low	56	Low	51 Å²	51	90.6 Å²	90.6	36%	0.357	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-22.5	174.9	63.7	0	0	0	0	113.4	E188 V189 M194 E195 N196	E188-S192 WeakPolarHBondContact O-CB 3.41Å; E188-S192 PolarHBondContact O-N 2.91Å; E188-S192 PolarHBondContact O-OG 3.35Å; V189-S192 PolarHBondContact O-OG 2.87Å; S192-M194 VanDerWaalsContact C-N 3.32Å; S192-E195 PolarHBondContact O-N 3.24Å; S192-N196 PolarHBondContact O-ND2 3.03Å
193	S	47.2	Very low	59	Low	46 Å²	46	88.3 Å²	88.3	32%	0.322	48%	0.475	S	S	.	.	H	α-helix	trans	-70.2	-28.4	174	82.4	0	0	0	0	112.8	V189 K190 A191	V189-S193 WeakPolarHBondContact O-CB 3.25Å; V189-S193 PolarHBondContact O-N 2.71Å; V189-S193 VanDerWaalsContact O-N 3.16Å; K190-S193 WeakPolarHBondContact O-CB 3.01Å; K190-S193 PolarHBondContact O-N 3.48Å; K190-S193 PolarHBondContact O-OG 2.89Å; A191-S193 PolarHBondContact O-N 3.32Å
194	M	45	Very low	62	Low	137 Å²	137	82.8 Å²	82.8	68%	0.675	45%	0.447	S	S	*	.	H	α-helix	trans	-79.2	-34.8	174	-73.9	-172.8	69.2	0	0	112.2	K190 A191 S192 N196 M197	K190-M194 PolarHBondContact O-N 2.77Å; A191-M194 PolarHBondContact O-N 3.47Å; A191-M194 VanDerWaalsContact O-N 3.12Å; S192-M194 VanDerWaalsContact C-N 3.32Å; M194-N196 PolarHBondContact O-N 3.46Å; M194-M197 HydrophobicContact CG-CE 3.98Å; M194-M197 PolarHBondContact O-N 3.03Å
195	E	56.1	Low	65	Low	165 Å²	165	82.4 Å²	82.4	77%	0.771	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-19.1	177.3	-73.4	-175.5	154.6	0	0	113.4	A191 S192	A191-E195 PolarHBondContact O-N 2.92Å; S192-E195 PolarHBondContact O-N 3.24Å
196	N	70	Confident	67.9	Low	65 Å²	65	82.5 Å²	82.5	35%	0.348	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	25.4	-177.9	-64.6	-55.2	0	0	0	113.3	S192 M194 H198	S192-N196 PolarHBondContact O-ND2 3.03Å; M194-N196 PolarHBondContact O-N 3.46Å; N196-H198 PolarHBondContact O-CD2 3.19Å
197	M	86.3	Confident	70.5	Confident	57 Å²	57	78.9 Å²	78.9	28%	0.281	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129	173.1	-66.2	-174.1	-178.8	0	0	110.6	I141 L149 V150 M194	I141-M197 HydrophobicContact CD1-CE 4.04Å; I141-M197 HydrophobicContact CG2-CE 4.28Å; L149-M197 HydrophobicContact CD1-SD 4.43Å; V150-M197 CarbonylContact O-C 3.56Å; V150-M197 WeakPolarHBondContact O-CA 3.46Å; M194-M197 HydrophobicContact CG-CE 3.98Å; M194-M197 PolarHBondContact O-N 3.03Å
198	H	91.1	Very high	73.3	Confident	56 Å²	56	74 Å²	74	26%	0.259	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	142.9	177.7	-61.1	-82	0	0	0	110.2	L149 V150 N196 L200 L203	L149-H198 WeakPolarHBondContact CA-O 3.17Å; V150-H198 HydrophobicContact CG2-CB 4.11Å; V150-H198 PolarHBondContact N-O 3.09Å; V150-H198 PolarHBondContact O-N 3.05Å; N196-H198 PolarHBondContact O-CD2 3.19Å; H198-L200 PolarHBondContact O-N 3.24Å; H198-L203 HydrophobicContact CB-CD1 4.04Å; H198-L203 HydrophobicContact CB-CD2 4.49Å; H198-L203 HydrophobicContact CB-CG 4.27Å
199	S	93.8	Very high	75.8	Confident	24 Å²	24	71.3 Å²	71.3	17%	0.168	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	124.4	169	166	0	0	0	0	109.6	D147 T201 E202 L203	D147-S199 VanDerWaalsContact CG-OG 3.29Å; D147-S199 PolarHBondContact OD1-OG 2.72Å; D147-S199 WeakPolarHBondContact OD2-CB 3.39Å; D147-S199 PolarHBondContact OD2-OG 3.1Å; S199-T201 VanDerWaalsContact C-N 3.26Å; S199-T201 PolarHBondContact O-N 3.43Å; S199-T201 PolarHBondContact OG-N 3.06Å; S199-E202 PolarHBondContact O-N 3.16Å; S199-E202 PolarHBondContact OG-N 3.1Å; S199-E202 VanDerWaalsContact OG-N 3.1Å; S199-L203 WeakPolarHBondContact O-CG 3.33Å; S199-L203 PolarHBondContact O-N 2.98Å
200	L	94	Very high	78	Confident	9 Å²	9	71.9 Å²	71.9	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-38.6	174.1	-179.4	64.1	0	0	0	110.8	Y99 L114 V148 V150 H198 E202 L203 Q204	Y99-L200 HydrophobicContact CD1-CD1 3.7Å; Y99-L200 HydrophobicContact CD1-CD2 4.42Å; Y99-L200 HydrophobicContact CD2-CD1 4.32Å; Y99-L200 HydrophobicContact CE1-CD1 3.77Å; Y99-L200 HydrophobicContact CE1-CD2 3.63Å; Y99-L200 HydrophobicContact CE1-CG 4.36Å; Y99-L200 HydrophobicContact CE2-CD1 4.37Å; Y99-L200 HydrophobicContact CE2-CD2 4.09Å; Y99-L200 HydrophobicContact CG-CD1 4Å; Y99-L200 VanDerWaalsContact CZ-CD2 3.43Å; Y99-L200 WeakPolarHBondContact OH-CD2 3.44Å; L114-L200 HydrophobicContact CD2-CD1 4.08Å; V148-L200 HydrophobicContact CB-CB 3.89Å; V148-L200 HydrophobicContact CB-CD2 3.83Å; V148-L200 HydrophobicContact CG1-CD2 4.26Å; V148-L200 HydrophobicContact CG2-CD2 4.21Å; V148-L200 WeakPolarHBondContact O-CB 3.36Å; V148-L200 PolarHBondContact O-N 2.79Å; V150-L200 HydrophobicContact CG1-CB 4.33Å; V150-L200 HydrophobicContact CG1-CD1 4.42Å; H198-L200 PolarHBondContact O-N 3.24Å; L200-E202 VanDerWaalsContact C-N 3.29Å; L200-E202 PolarHBondContact O-N 3.21Å; L200-L203 PolarHBondContact O-N 3.06Å; L200-Q204 HydrophobicContact CD1-CG 4.42Å; L200-Q204 HydrophobicContact CG-CG 4.35Å; L200-Q204 WeakPolarHBondContact O-CB 3.34Å; L200-Q204 VanDerWaalsContact O-CG 3.29Å; L200-Q204 WeakPolarHBondContact O-CG 3.33Å; L200-Q204 PolarHBondContact O-N 3.27Å
201	T	93.7	Very high	80.1	Confident	71 Å²	71	73.3 Å²	73.3	44%	0.436	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-40.6	177.1	-56.8	0	0	0	0	111.3	D147 S199 Q204 K205	D147-T201 WeakPolarHBondContact OD1-CB 3.39Å; D147-T201 PolarHBondContact OD1-N 2.04Å; D147-T201 VanDerWaalsContact OD1-N 3.11Å; D147-T201 PolarHBondContact OD1-OG1 3.28Å; S199-T201 VanDerWaalsContact C-N 3.26Å; S199-T201 PolarHBondContact O-N 3.43Å; S199-T201 PolarHBondContact OG-N 3.06Å; T201-Q204 PolarHBondContact O-N 3.27Å; T201-K205 WeakPolarHBondContact O-CB 3.5Å; T201-K205 PolarHBondContact O-N 2.69Å
202	E	94	Very high	82.3	Confident	112 Å²	112	74 Å²	74	52%	0.523	37%	0.373	S	S	.	.	H	α-helix	trans	-65.7	-44.2	174.9	-173.1	179.7	179.9	0	0	112	S199 L200 Q204 K205 N206	S199-E202 PolarHBondContact O-N 3.16Å; S199-E202 PolarHBondContact OG-N 3.1Å; S199-E202 VanDerWaalsContact OG-N 3.1Å; L200-E202 VanDerWaalsContact C-N 3.29Å; L200-E202 PolarHBondContact O-N 3.21Å; E202-Q204 VanDerWaalsContact C-N 3.32Å; E202-Q204 PolarHBondContact O-N 2.86Å; E202-K205 PolarHBondContact O-N 2.98Å; E202-N206 WeakPolarHBondContact O-CB 3.36Å; E202-N206 PolarHBondContact O-N 3.47Å; E202-N206 PolarHBondContact O-ND2 3.33Å
203	L	95.5	Very high	84.3	Confident	15 Å²	15	75.2 Å²	75.2	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-42.8	175.5	-67.9	179	0	0	0	111.7	L101 Y112 L114 V150 H198 S199 L200 N206 S207	L101-L203 HydrophobicContact CD1-CD1 4.41Å; L101-L203 HydrophobicContact CD2-CD1 4.42Å; L101-L203 HydrophobicContact CD2-CD2 3.99Å; Y112-L203 WeakPolarHBondContact OH-CA 3.44Å; Y112-L203 PolarHBondContact OH-O 3.37Å; Y112-L203 VanDerWaalsContact OH-O 3.04Å; L114-L203 HydrophobicContact CD2-CB 4.18Å; V150-L203 HydrophobicContact CG2-CD1 3.6Å; H198-L203 HydrophobicContact CB-CD1 4.04Å; H198-L203 HydrophobicContact CB-CD2 4.49Å; H198-L203 HydrophobicContact CB-CG 4.27Å; S199-L203 WeakPolarHBondContact O-CG 3.33Å; S199-L203 PolarHBondContact O-N 2.98Å; L200-L203 PolarHBondContact O-N 3.06Å; L203-N206 PolarHBondContact O-N 3.43Å; L203-S207 PolarHBondContact O-N 3.38Å
204	Q	95.2	Very high	86.4	Confident	81 Å²	81	76.8 Å²	76.8	38%	0.379	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-46.7	175.2	-75.9	173.3	-22	0	0	111.3	L114 L200 T201 E202 N206 S207 N210	L114-Q204 HydrophobicContact CD2-CB 4.16Å; L114-Q204 HydrophobicContact CD2-CG 3.37Å; L200-Q204 HydrophobicContact CD1-CG 4.42Å; L200-Q204 HydrophobicContact CG-CG 4.35Å; L200-Q204 WeakPolarHBondContact O-CB 3.34Å; L200-Q204 VanDerWaalsContact O-CG 3.29Å; L200-Q204 WeakPolarHBondContact O-CG 3.33Å; L200-Q204 PolarHBondContact O-N 3.27Å; T201-Q204 PolarHBondContact O-N 3.27Å; E202-Q204 VanDerWaalsContact C-N 3.32Å; E202-Q204 PolarHBondContact O-N 2.86Å; Q204-N206 PolarHBondContact O-N 3.23Å; Q204-S207 PolarHBondContact O-N 3.43Å; Q204-S207 PolarHBondContact O-OG 3.39Å; Q204-N210 VanDerWaalsContact C-ND2 3.34Å; Q204-N210 WeakPolarHBondContact O-CB 3.29Å; Q204-N210 PolarHBondContact O-ND2 3.28Å
205	K	95.2	Very high	88.8	Confident	152 Å²	152	73.3 Å²	73.3	66%	0.661	36%	0.359	S	S	*	.	H	α-helix	trans	-60.3	-35	179.4	-176.8	-179.1	177	-175.8	0	112.4	T201 E202	T201-K205 WeakPolarHBondContact O-CB 3.5Å; T201-K205 PolarHBondContact O-N 2.69Å; E202-K205 PolarHBondContact O-N 2.98Å
206	N	95	Very high	90.9	Very high	72 Å²	72	67.6 Å²	67.6	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-88.1	-18.7	-175.4	-72.1	-27.8	0	0	0	113.5	Y112 E202 L203 Q204 K211	Y112-N206 HydrophobicContact CE1-CB 4.42Å; Y112-N206 VanDerWaalsContact OH-CB 3.3Å; Y112-N206 WeakPolarHBondContact OH-CB 3.44Å; E202-N206 WeakPolarHBondContact O-CB 3.36Å; E202-N206 PolarHBondContact O-N 3.47Å; E202-N206 PolarHBondContact O-ND2 3.33Å; L203-N206 PolarHBondContact O-N 3.43Å; Q204-N206 PolarHBondContact O-N 3.23Å; N206-K211 PolarHBondContact O-NZ 3.48Å
207	S	96.4	Very high	92.3	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.014	33%	0.332	C	S	.	.	S	Bend	trans	-65.4	150.2	178.7	83.1	0	0	0	0	112.3	Y112 L203 Q204 N209 N210	Y112-S207 WeakPolarHBondContact O-CA 3.26Å; L203-S207 PolarHBondContact O-N 3.38Å; Q204-S207 PolarHBondContact O-N 3.43Å; Q204-S207 PolarHBondContact O-OG 3.39Å; S207-N209 VanDerWaalsContact C-N 3.33Å; S207-N209 VanDerWaalsContact CB-OD1 3.26Å; S207-N209 WeakPolarHBondContact CB-OD1 3.14Å; S207-N209 PolarHBondContact OG-OD1 3.44Å; S207-N210 WeakPolarHBondContact OG-CB 3.41Å
208	I	94.8	Very high	92.7	Very high	32 Å²	32	68.5 Å²	68.5	16%	0.164	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-76.3	-23.9	-178.7	68.2	-178.2	0	0	0	113	P111 Y112 I113 F129 N210	P111-I208 HydrophobicContact CB-CG2 3.8Å; Y112-I208 WeakPolarHBondContact O-CG1 3.48Å; Y112-I208 PolarHBondContact O-N 3.4Å; I113-I208 HydrophobicContact CD1-CD1 4.18Å; I113-I208 HydrophobicContact CG1-CD1 3.51Å; I113-I208 HydrophobicContact CG1-CG1 3.57Å; F129-I208 HydrophobicContact CB-CD1 4.03Å; F129-I208 HydrophobicContact CD2-CD1 3.17Å; F129-I208 HydrophobicContact CE2-CD1 3.77Å; F129-I208 HydrophobicContact CG-CD1 3.9Å; I208-N210 PolarHBondContact O-N 3.36Å
209	N	93.5	Very high	92.8	Very high	39 Å²	39	69.5 Å²	69.5	21%	0.209	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-87.4	7.3	-179.1	66	-43.1	0	0	0	113.4	I113 L114 Y127 S207	I113-N209 HydrophobicContact CG2-CB 4.4Å; L114-N209 PolarHBondContact N-OD1 3.38Å; L114-N209 VanDerWaalsContact N-OD1 3.08Å; L114-N209 PolarHBondContact O-ND2 3.32Å; Y127-N209 HydrophobicContact CD1-CB 3.92Å; Y127-N209 HydrophobicContact CD2-CB 4.31Å; Y127-N209 HydrophobicContact CE1-CB 3.61Å; Y127-N209 HydrophobicContact CE2-CB 4.02Å; Y127-N209 HydrophobicContact CG-CB 4.26Å; S207-N209 VanDerWaalsContact C-N 3.33Å; S207-N209 VanDerWaalsContact CB-OD1 3.26Å; S207-N209 WeakPolarHBondContact CB-OD1 3.14Å; S207-N209 PolarHBondContact OG-OD1 3.44Å
210	N	89.5	Confident	92.7	Very high	102 Å²	102	73.3 Å²	73.3	55%	0.545	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-121	10.4	173.5	-167.3	48.7	0	0	0	111.9	Q204 S207 I208	Q204-N210 VanDerWaalsContact C-ND2 3.34Å; Q204-N210 WeakPolarHBondContact O-CB 3.29Å; Q204-N210 PolarHBondContact O-ND2 3.28Å; S207-N210 WeakPolarHBondContact OG-CB 3.41Å; I208-N210 PolarHBondContact O-N 3.36Å
211	K	76	Confident	92.6	Very high	192 Å²	192	79.1 Å²	79.1	84%	0.835	38%	0.384	S	S	*	.			trans	-108.9	0	176	-70.4	175.3	-177.4	169.8	0	109.6	N206	N206-K211 PolarHBondContact O-NZ 3.48Å

Retrieved 211 of 211 residues in 81.5 ms (Link to these results)

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