A0A5K4F736_SCHMA Loading...

PSP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F736, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 195 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	36.6	Very low	52.1	Low	223 Å²	223	128 Å²	128	100%	1.099	67%	0.672	S	S	*	*				0	76.7	0	-60	-67.8	177.4	0	0	106.8
2	T	44.9	Very low	52.7	Low	118 Å²	118	129 Å²	129	72%	0.724	68%	0.679	S	S	*	*			trans	-113.4	82.8	170.8	49.5	0	0	0	0	104.9	N4	T2-N4 VanDerWaalsContact C-N 3.29Å; T2-N4 PolarHBondContact O-N 2.9Å
3	D	51.7	Low	52.5	Low	131 Å²	131	131.2 Å²	131.2	70%	0.701	68%	0.679	S	S	*	*			trans	-67.8	97.8	171.1	-63.2	-26.3	0	0	0	105.6	Q5	D3-Q5 PolarHBondContact O-N 3.41Å
4	N	49.2	Very low	51.2	Low	113 Å²	113	130.8 Å²	130.8	60%	0.604	69%	0.691	S	S	*	*			trans	-68	79.9	172.7	-64.5	-34.4	0	0	0	107.2	T2 D6 D7	T2-N4 VanDerWaalsContact C-N 3.29Å; T2-N4 PolarHBondContact O-N 2.9Å; N4-D6 PolarHBondContact O-N 2.87Å; N4-D6 VanDerWaalsContact O-N 3.07Å; N4-D7 PolarHBondContact O-N 2.69Å
5	Q	58.4	Low	50.6	Low	133 Å²	133	126.7 Å²	126.7	62%	0.621	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-66.2	-5	178.4	-149.7	97.8	26.2	0	0	112.3	D3	D3-Q5 PolarHBondContact O-N 3.41Å
6	D	55.8	Low	50.1	Low	144 Å²	144	126.9 Å²	126.9	77%	0.77	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-79.9	-14.7	-178.7	-62.4	-38.5	0	0	0	113.1	N4	N4-D6 PolarHBondContact O-N 2.87Å; N4-D6 VanDerWaalsContact O-N 3.07Å
7	D	55.3	Low	49.7	Very low	124 Å²	124	124.6 Å²	124.6	66%	0.663	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-87.2	-2.5	-177.4	-72.7	-21.6	0	0	0	114.5	N4 F9	N4-D7 PolarHBondContact O-N 2.69Å; D7-F9 VanDerWaalsContact C-N 3.28Å; D7-F9 PolarHBondContact O-N 2.74Å
8	I	59.7	Low	49.5	Very low	119 Å²	119	127.3 Å²	127.3	61%	0.61	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-72	-22.9	178.3	-92.3	171.1	0	0	0	112.8
9	F	47.8	Very low	49.1	Very low	79 Å²	79	128.1 Å²	128.1	35%	0.346	72%	0.715	S	S	.	*			trans	-108.1	72.9	-175.2	-60.4	-75	0	0	0	110.7	D7 I11 I86	D7-F9 VanDerWaalsContact C-N 3.28Å; D7-F9 PolarHBondContact O-N 2.74Å; F9-I11 PolarHBondContact O-N 2.57Å; F9-I86 HydrophobicContact CB-CD1 4.07Å; F9-I86 HydrophobicContact CD1-CD1 4.17Å; F9-I86 HydrophobicContact CG-CD1 4.07Å
10	V	59.7	Low	48.9	Very low	118 Å²	118	129.5 Å²	129.5	72%	0.715	72%	0.721	S	S	*	*			trans	-64.4	105.7	163.1	-178.6	0	0	0	0	107.2	D12	V10-D12 PolarHBondContact O-N 3.15Å
11	I	53.9	Low	48.5	Very low	106 Å²	106	133.2 Å²	133.2	54%	0.544	73%	0.729	S	S	.	*			trans	-73.2	97.7	170.1	-59.3	170.1	0	0	0	105.5	F9 K13	F9-I11 PolarHBondContact O-N 2.57Å; I11-K13 HydrophobicContact CG2-CG 4.02Å; I11-K13 PolarHBondContact O-N 2.83Å
12	D	59.2	Low	48.5	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	72%	0.716	S	S	*	*			trans	-56.9	101.5	171.5	-93.3	-19	0	0	0	108.8	V10	V10-D12 PolarHBondContact O-N 3.15Å
13	K	50.6	Low	48.3	Very low	158 Å²	158	130.1 Å²	130.1	69%	0.687	71%	0.713	S	S	*	*			trans	-93.9	5.6	173.9	-70.6	-155.6	-179.2	-165.3	0	113.1	I11	I11-K13 HydrophobicContact CG2-CG 4.02Å; I11-K13 PolarHBondContact O-N 2.83Å
14	C	34	Very low	47.7	Very low	125 Å²	125	129.8 Å²	129.8	85%	0.845	71%	0.711	S	S	*	*			trans	-121.6	99.3	-173.4	-74.7	0	0	0	0	111
15	G	42.6	Very low	47.4	Very low	69 Å²	69	130 Å²	130	71%	0.711	71%	0.711	S	S	*	*			trans	-169	42.7	174.9	0	0	0	0	0	111.8	S17	G15-S17 VanDerWaalsContact C-N 3.27Å; G15-S17 PolarHBondContact O-N 3.17Å
16	S	41.9	Very low	46.7	Very low	130 Å²	130	126.8 Å²	126.8	91%	0.909	70%	0.701	S	S	*	*			trans	-90.7	63.1	164.7	64.1	0	0	0	0	109.3
17	S	43.4	Very low	46.4	Very low	89 Å²	89	123.4 Å²	123.4	62%	0.622	68%	0.678	S	S	*	*			trans	-116.1	122.7	159.2	52.3	0	0	0	0	106.7	G15 D19	G15-S17 VanDerWaalsContact C-N 3.27Å; G15-S17 PolarHBondContact O-N 3.17Å; S17-D19 VanDerWaalsContact C-N 3.32Å; S17-D19 PolarHBondContact O-N 2.98Å
18	L	46.2	Very low	46.1	Very low	173 Å²	173	121.1 Å²	121.1	91%	0.906	67%	0.666	S	S	*	*			trans	-61.5	92	176.4	-64.9	165.9	0	0	0	108.4
19	D	42.4	Very low	45.8	Very low	142 Å²	142	119.4 Å²	119.4	76%	0.759	65%	0.654	S	S	*	*			trans	-138.4	102.5	163	-82.8	-45	0	0	0	108.4	S17	S17-D19 VanDerWaalsContact C-N 3.32Å; S17-D19 PolarHBondContact O-N 2.98Å
20	D	45.6	Very low	45.9	Very low	155 Å²	155	118.9 Å²	118.9	83%	0.829	66%	0.657	S	S	*	*			trans	-61.7	137.6	173.7	-62.3	-54.6	0	0	0	110.3
21	K	40.7	Very low	45.6	Very low	208 Å²	208	122 Å²	122	90%	0.904	66%	0.664	S	S	*	*			trans	99	51.6	175.4	-54.4	168.4	-177.8	176.7	0	116.3
22	Q	36.3	Very low	45.5	Very low	174 Å²	174	122.9 Å²	122.9	81%	0.813	67%	0.669	S	S	*	*			trans	-79.9	145.3	148.2	-86	-96.2	-55.2	0	0	109.5	D24	Q22-D24 PolarHBondContact O-N 3.29Å
23	P	39.9	Very low	45.1	Very low	102 Å²	102	125 Å²	125	66%	0.662	67%	0.674	S	S	*	*			trans	-60.1	128.7	-177.9	25.2	-33.1	0	0	0	110.3	I25	P23-I25 VanDerWaalsContact C-N 3.26Å; P23-I25 PolarHBondContact O-N 2.47Å
24	D	39.8	Very low	45.3	Very low	124 Å²	124	124.3 Å²	124.3	66%	0.663	67%	0.674	S	S	*	*			trans	-64.9	77.6	-176.9	-173.1	5.1	0	0	0	111.4	Q22 T26	Q22-D24 PolarHBondContact O-N 3.29Å; D24-T26 PolarHBondContact O-N 2.94Å; D24-T26 WeakPolarHBondContact OD1-CA 3.08Å; D24-T26 WeakPolarHBondContact OD1-CB 3.42Å; D24-T26 PolarHBondContact OD1-N 2.79Å; D24-T26 PolarHBondContact OD1-OG1 3.04Å
25	I	43	Very low	45.9	Very low	118 Å²	118	126.3 Å²	126.3	61%	0.605	67%	0.671	S	S	*	*			trans	-88.4	31	156.2	61.8	162.1	0	0	0	109.7	P23 Y27 I84	P23-I25 VanDerWaalsContact C-N 3.26Å; P23-I25 PolarHBondContact O-N 2.47Å; I25-Y27 PolarHBondContact O-N 2.84Å; I25-I84 HydrophobicContact CD1-CD1 3.74Å
26	T	43.2	Very low	45.9	Very low	65 Å²	65	127.9 Å²	127.9	40%	0.399	67%	0.671	S	S	.	*			trans	-61.3	125.5	-174.5	-54.6	0	0	0	0	107.1	D24 D28	D24-T26 PolarHBondContact O-N 2.94Å; D24-T26 WeakPolarHBondContact OD1-CA 3.08Å; D24-T26 WeakPolarHBondContact OD1-CB 3.42Å; D24-T26 PolarHBondContact OD1-N 2.79Å; D24-T26 PolarHBondContact OD1-OG1 3.04Å; T26-D28 HydrophobicContact CG2-CB 4.41Å; T26-D28 PolarHBondContact O-N 2.55Å
27	Y	49.6	Very low	46.1	Very low	73 Å²	73	129.2 Å²	129.2	29%	0.286	67%	0.667	S	S	.	*			trans	-61.2	83.1	151.5	-73.8	-92	0	0	0	104.9	I25 F29 I84 I88	I25-Y27 PolarHBondContact O-N 2.84Å; Y27-F29 VanDerWaalsContact C-N 3.33Å; Y27-F29 WeakPolarHBondContact O-CD2 3.33Å; Y27-F29 VanDerWaalsContact O-CE2 3.3Å; Y27-F29 WeakPolarHBondContact O-CE2 3.46Å; Y27-F29 PolarHBondContact O-N 3.27Å; Y27-I84 HydrophobicContact CE2-CB 4.4Å; Y27-I84 HydrophobicContact CE2-CD1 4.46Å; Y27-I84 HydrophobicContact CE2-CG1 4Å; Y27-I84 HydrophobicContact CE2-CG2 4.04Å; Y27-I88 WeakPolarHBondContact OH-CG1 3.42Å; Y27-I88 WeakPolarHBondContact OH-CG2 2.79Å
28	D	49.7	Very low	45.9	Very low	77 Å²	77	129.6 Å²	129.6	41%	0.412	67%	0.665	S	S	.	*			trans	-62.7	105.6	-171.1	-170.1	4.7	0	0	0	107.1	T26 T30 R68	T26-D28 HydrophobicContact CG2-CB 4.41Å; T26-D28 PolarHBondContact O-N 2.55Å; D28-T30 PolarHBondContact O-N 2.83Å; D28-T30 VanDerWaalsContact O-N 3.17Å; D28-T30 WeakPolarHBondContact OD1-CB 3.49Å; D28-T30 WeakPolarHBondContact OD1-CG2 3.3Å; D28-T30 PolarHBondContact OD1-N 2.53Å; D28-T30 PolarHBondContact OD1-OG1 2.68Å; D28-T30 WeakPolarHBondContact OD2-CB 3.27Å; D28-T30 WeakPolarHBondContact OD2-CG2 3.02Å; D28-T30 PolarHBondContact OD2-OG1 2.63Å; D28-R68 PolarHBondContact O-NH1 2.73Å; D28-R68 PolarHBondContact O-NH2 3.24Å
29	F	51.7	Low	45.8	Very low	83 Å²	83	128 Å²	128	36%	0.364	66%	0.663	S	S	.	*			trans	-71.4	6.2	173.3	-70	-84.2	0	0	0	110	Y27 E31 S81	Y27-F29 VanDerWaalsContact C-N 3.33Å; Y27-F29 WeakPolarHBondContact O-CD2 3.33Å; Y27-F29 VanDerWaalsContact O-CE2 3.3Å; Y27-F29 WeakPolarHBondContact O-CE2 3.46Å; Y27-F29 PolarHBondContact O-N 3.27Å; F29-E31 VanDerWaalsContact C-N 3.31Å; F29-E31 PolarHBondContact O-N 3.26Å; F29-S81 WeakPolarHBondContact CE2-O 3.26Å
30	T	51.4	Low	45.9	Very low	68 Å²	68	124.7 Å²	124.7	42%	0.417	65%	0.651	S	S	.	*			trans	-34.6	109	167.8	28.1	0	0	0	0	106.1	D28 L32	D28-T30 PolarHBondContact O-N 2.83Å; D28-T30 VanDerWaalsContact O-N 3.17Å; D28-T30 WeakPolarHBondContact OD1-CB 3.49Å; D28-T30 WeakPolarHBondContact OD1-CG2 3.3Å; D28-T30 PolarHBondContact OD1-N 2.53Å; D28-T30 PolarHBondContact OD1-OG1 2.68Å; D28-T30 WeakPolarHBondContact OD2-CB 3.27Å; D28-T30 WeakPolarHBondContact OD2-CG2 3.02Å; D28-T30 PolarHBondContact OD2-OG1 2.63Å; T30-L32 PolarHBondContact O-N 2.76Å
31	E	52.1	Low	45.8	Very low	183 Å²	183	122.9 Å²	122.9	86%	0.855	65%	0.65	S	S	*	*			trans	-60.1	78.4	157	-67.6	170.1	-179.7	0	0	102	F29 E33	F29-E31 VanDerWaalsContact C-N 3.31Å; F29-E31 PolarHBondContact O-N 3.26Å; E31-E33 PolarHBondContact O-N 2.74Å
32	L	51.9	Low	46.2	Very low	125 Å²	125	119.9 Å²	119.9	65%	0.654	64%	0.64	S	S	*	*			trans	-50	107.5	142.5	-69.1	178.9	0	0	0	100.7	T30 E34	T30-L32 PolarHBondContact O-N 2.76Å; L32-E34 PolarHBondContact O-N 2.74Å
33	E	51.4	Low	46.5	Very low	183 Å²	183	116.3 Å²	116.3	86%	0.855	63%	0.626	S	S	*	*			trans	-47.1	99.1	173.4	-63.4	-169.3	170.9	0	0	103.8	E31 E35	E31-E33 PolarHBondContact O-N 2.74Å; E33-E35 PolarHBondContact O-N 3.18Å
34	E	54.5	Low	46.8	Very low	145 Å²	145	117.5 Å²	117.5	68%	0.678	63%	0.634	S	S	*	*			trans	-67.9	91.4	171.5	-74.3	-165.6	162.1	0	0	100.3	L32 S36	L32-E34 PolarHBondContact O-N 2.74Å; E34-S36 VanDerWaalsContact C-N 3.35Å; E34-S36 VanDerWaalsContact O-CA 3.27Å; E34-S36 WeakPolarHBondContact O-CA 2.94Å; E34-S36 PolarHBondContact O-N 2.97Å
35	E	46.1	Very low	47.1	Very low	166 Å²	166	121.2 Å²	121.2	78%	0.776	64%	0.639	S	S	*	*			trans	-19.2	103.9	167.7	178.7	-177.3	-133.8	0	0	105	E33 L37	E33-E35 PolarHBondContact O-N 3.18Å; E35-L37 PolarHBondContact O-N 3.22Å
36	S	42.7	Very low	47.7	Very low	102 Å²	102	120.1 Å²	120.1	71%	0.713	64%	0.641	S	S	*	*			trans	-46.7	92.4	-162.8	53.9	0	0	0	0	108.1	E34 T38	E34-S36 VanDerWaalsContact C-N 3.35Å; E34-S36 VanDerWaalsContact O-CA 3.27Å; E34-S36 WeakPolarHBondContact O-CA 2.94Å; E34-S36 PolarHBondContact O-N 2.97Å; S36-T38 PolarHBondContact O-N 3.31Å
37	L	45.8	Very low	48.4	Very low	159 Å²	159	127.6 Å²	127.6	83%	0.832	66%	0.662	S	S	*	*			trans	-72.5	87.3	160.3	-75.5	173	0	0	0	98.2	E35 T39	E35-L37 PolarHBondContact O-N 3.22Å; L37-T39 PolarHBondContact O-N 3.25Å
38	T	40	Very low	49.1	Very low	96 Å²	96	132 Å²	132	59%	0.589	68%	0.683	S	S	*	*			trans	-29.8	135.2	165.1	57.1	0	0	0	0	104.8	S36 S40	S36-T38 PolarHBondContact O-N 3.31Å; T38-S40 PolarHBondContact O-N 3.47Å
39	T	44.6	Very low	49.8	Very low	140 Å²	140	133 Å²	133	86%	0.859	69%	0.694	S	S	*	*			trans	-54.7	74.4	152.4	54.2	0	0	0	0	105.7	L37 S41	L37-T39 PolarHBondContact O-N 3.25Å; T39-S41 PolarHBondContact O-N 2.96Å
40	S	43.6	Very low	50.4	Low	73 Å²	73	133.4 Å²	133.4	51%	0.51	70%	0.703	S	S	.	*			trans	-62	104.7	165.1	69.9	0	0	0	0	98	T38 Q42	T38-S40 PolarHBondContact O-N 3.47Å; S40-Q42 PolarHBondContact O-N 3.22Å
41	S	44.4	Very low	51.5	Low	116 Å²	116	140.4 Å²	140.4	81%	0.811	72%	0.723	S	S	*	*			trans	-40.1	92.5	163.4	-70.7	0	0	0	0	106.1	T39 N43	T39-S41 PolarHBondContact O-N 2.96Å; S41-N43 PolarHBondContact O-N 3.09Å
42	Q	47.5	Very low	52.7	Low	145 Å²	145	135.2 Å²	135.2	68%	0.678	72%	0.718	S	S	*	*			trans	-74.1	86.8	165.5	-72.7	-158.6	5.6	0	0	101.8	S40	S40-Q42 PolarHBondContact O-N 3.22Å
43	N	42.8	Very low	53.8	Low	100 Å²	100	133.7 Å²	133.7	54%	0.535	71%	0.706	S	S	.	*			trans	-19.3	122.1	150.1	176.8	-4.7	0	0	0	107	S41 R45	S41-N43 PolarHBondContact O-N 3.09Å; N43-R45 HydrophobicContact CB-CG 4.23Å; N43-R45 PolarHBondContact O-N 3.5Å
44	P	47	Very low	54.9	Low	127 Å²	127	133 Å²	133	83%	0.825	70%	0.696	S	S	*	*			trans	-65	71	173	29.1	-34.2	0	0	0	107.8	S46	P44-S46 PolarHBondContact O-N 3.34Å
45	R	46.5	Very low	55.7	Low	202 Å²	202	135 Å²	135	76%	0.762	70%	0.699	S	S	*	*			trans	-65.6	100.9	166.1	-73.5	-173.5	178.6	161.4	0.5	102.5	N43 R47	N43-R45 HydrophobicContact CB-CG 4.23Å; N43-R45 PolarHBondContact O-N 3.5Å; R45-R47 PolarHBondContact O-N 2.61Å
46	S	54.2	Low	56.7	Low	94 Å²	94	132.8 Å²	132.8	66%	0.657	69%	0.688	S	S	*	*			trans	0.3	95.4	152.8	178.7	0	0	0	0	109.9	P44 K48	P44-S46 PolarHBondContact O-N 3.34Å; S46-K48 PolarHBondContact O-N 3.17Å
47	R	58.3	Low	58	Low	222 Å²	222	131.9 Å²	131.9	84%	0.838	67%	0.672	S	S	*	*			trans	-65.2	83.1	169.8	-80.4	-177.3	143.8	106.1	0.8	105.5	R45 P49	R45-R47 PolarHBondContact O-N 2.61Å; R47-P49 WeakPolarHBondContact O-CD 3.48Å
48	K	65.3	Low	59.1	Low	165 Å²	165	126.1 Å²	126.1	72%	0.717	65%	0.648	S	S	*	*			trans	-59.5	121	164.3	-73.8	-175.3	178	179.7	0	104.5	S46 V50	S46-K48 PolarHBondContact O-N 3.17Å; K48-V50 PolarHBondContact O-N 2.62Å
49	P	63.8	Low	60.4	Low	99 Å²	99	128.3 Å²	128.3	64%	0.643	66%	0.656	S	S	*	*			trans	-56.5	112.7	174	23.3	-31.5	0	0	0	106.4	R47 Y51	R47-P49 WeakPolarHBondContact O-CD 3.48Å; P49-Y51 HydrophobicContact CB-CD2 4.31Å; P49-Y51 HydrophobicContact CB-CE2 4.33Å; P49-Y51 HydrophobicContact CG-CD2 4.3Å; P49-Y51 HydrophobicContact CG-CE2 4.13Å; P49-Y51 PolarHBondContact O-N 2.67Å
50	V	65.3	Low	61.3	Low	91 Å²	91	128.2 Å²	128.2	55%	0.552	64%	0.644	S	S	*	*			trans	-74.2	87.6	173.4	-173.3	0	0	0	0	105.7	K48 G52 K53	K48-V50 PolarHBondContact O-N 2.62Å; V50-G52 PolarHBondContact O-N 3.25Å; V50-K53 HydrophobicContact CB-CB 4.33Å; V50-K53 HydrophobicContact CB-CD 3.96Å; V50-K53 HydrophobicContact CB-CG 4.17Å; V50-K53 HydrophobicContact CG1-CB 4.1Å; V50-K53 HydrophobicContact CG1-CD 3.61Å; V50-K53 HydrophobicContact CG1-CG 3.54Å; V50-K53 HydrophobicContact CG2-CD 4.34Å; V50-K53 PolarHBondContact O-N 3Å
51	Y	73.1	Confident	62.4	Low	216 Å²	216	128.7 Å²	128.7	85%	0.847	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	124.8	168.5	-90.5	-92.7	0	0	0	108.2	P49	P49-Y51 HydrophobicContact CB-CD2 4.31Å; P49-Y51 HydrophobicContact CB-CE2 4.33Å; P49-Y51 HydrophobicContact CG-CD2 4.3Å; P49-Y51 HydrophobicContact CG-CE2 4.13Å; P49-Y51 PolarHBondContact O-N 2.67Å
52	G	76.9	Confident	63.5	Low	73 Å²	73	130.4 Å²	130.4	75%	0.753	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.6	-11.2	175.7	0	0	0	0	0	116	V50 R54	V50-G52 PolarHBondContact O-N 3.25Å; G52-R54 PolarHBondContact O-N 3.32Å
53	K	75.7	Confident	64.8	Low	93 Å²	93	130.9 Å²	130.9	40%	0.404	64%	0.641	S	S	.	*			trans	-78	123.7	169.5	-82.1	-174.2	177	-153.4	0	109.9	V50 E57 D59	V50-K53 HydrophobicContact CB-CB 4.33Å; V50-K53 HydrophobicContact CB-CD 3.96Å; V50-K53 HydrophobicContact CB-CG 4.17Å; V50-K53 HydrophobicContact CG1-CB 4.1Å; V50-K53 HydrophobicContact CG1-CD 3.61Å; V50-K53 HydrophobicContact CG1-CG 3.54Å; V50-K53 HydrophobicContact CG2-CD 4.34Å; V50-K53 PolarHBondContact O-N 3Å; K53-E57 WeakPolarHBondContact CA-OE2 3.49Å; K53-E57 HydrophobicContact CB-CB 4.28Å; K53-E57 HydrophobicContact CG-CB 4.29Å; K53-E57 PolarHBondContact NZ-O 3.02Å; K53-D59 IonicContact NZ-OD2 2.88Å; K53-D59 PolarHBondContact NZ-OD2 2.78Å
54	R	75.2	Confident	66.5	Low	168 Å²	168	134.9 Å²	134.9	63%	0.634	65%	0.65	S	S	*	*			trans	-67.5	157	170.4	-60.4	178.1	179.7	-101.5	-0.4	109	G52 H56 E57 A58	G52-R54 PolarHBondContact O-N 3.32Å; R54-H56 WeakPolarHBondContact CB-CE1 3.49Å; R54-H56 VanDerWaalsContact CD-CE1 3.43Å; R54-H56 WeakPolarHBondContact CD-CE1 3.4Å; R54-H56 PolarHBondContact O-N 3.3Å; R54-E57 HydrophobicContact CB-CG 4.12Å; R54-E57 PolarHBondContact N-OE2 3.46Å; R54-E57 WeakPolarHBondContact O-CB 3.47Å; R54-E57 PolarHBondContact O-N 3.25Å; R54-A58 PolarHBondContact O-N 3.02Å
55	Y	70.5	Confident	67.9	Low	189 Å²	189	136.1 Å²	136.1	74%	0.741	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-9.4	-178.9	73.7	-88	0	0	0	114.5	F60	Y55-F60 WeakPolarHBondContact O-CD2 3.34Å; Y55-F60 WeakPolarHBondContact O-CE2 3.37Å
56	H	68.7	Low	69.4	Low	118 Å²	118	132 Å²	132	55%	0.546	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.3	-6.5	172.8	53.8	-92.4	0	0	0	113.4	R54	R54-H56 WeakPolarHBondContact CB-CE1 3.49Å; R54-H56 VanDerWaalsContact CD-CE1 3.43Å; R54-H56 WeakPolarHBondContact CD-CE1 3.4Å; R54-H56 PolarHBondContact O-N 3.3Å
57	E	68.6	Low	70.7	Confident	83 Å²	83	130 Å²	130	39%	0.388	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104	-12.9	179.8	-60.7	168.4	-178.4	0	0	112.3	K53 R54 D59	K53-E57 WeakPolarHBondContact CA-OE2 3.49Å; K53-E57 HydrophobicContact CB-CB 4.28Å; K53-E57 HydrophobicContact CG-CB 4.29Å; K53-E57 PolarHBondContact NZ-O 3.02Å; R54-E57 HydrophobicContact CB-CG 4.12Å; R54-E57 PolarHBondContact N-OE2 3.46Å; R54-E57 WeakPolarHBondContact O-CB 3.47Å; R54-E57 PolarHBondContact O-N 3.25Å; E57-D59 PolarHBondContact O-N 3.08Å
58	A	69.8	Low	71.9	Confident	39 Å²	39	125.6 Å²	125.6	32%	0.322	62%	0.615	S	S	.	*	S	Bend	trans	-66.5	131.2	162.6	0	0	0	0	0	107.2	R54 F60	R54-A58 PolarHBondContact O-N 3.02Å; A58-F60 HydrophobicContact CB-CD2 3.88Å; A58-F60 HydrophobicContact CB-CE2 3.69Å; A58-F60 WeakPolarHBondContact O-CD2 3.28Å; A58-F60 PolarHBondContact O-N 3.35Å
59	D	67.7	Low	72.9	Confident	142 Å²	142	119.1 Å²	119.1	76%	0.759	59%	0.588	S	S	*	*			trans	-65.1	77.3	169.4	-51.6	-68.4	0	0	0	106.9	K53 E57 D61	K53-D59 IonicContact NZ-OD2 2.88Å; K53-D59 PolarHBondContact NZ-OD2 2.78Å; E57-D59 PolarHBondContact O-N 3.08Å; D59-D61 PolarHBondContact O-N 2.87Å
60	F	62.1	Low	74	Confident	138 Å²	138	117.7 Å²	117.7	61%	0.605	58%	0.58	S	S	*	*			trans	-61.9	126.8	168	-84.4	-87.1	0	0	0	105.3	Y55 A58 N62	Y55-F60 WeakPolarHBondContact O-CD2 3.34Å; Y55-F60 WeakPolarHBondContact O-CE2 3.37Å; A58-F60 HydrophobicContact CB-CD2 3.88Å; A58-F60 HydrophobicContact CB-CE2 3.69Å; A58-F60 WeakPolarHBondContact O-CD2 3.28Å; A58-F60 PolarHBondContact O-N 3.35Å; F60-N62 PolarHBondContact O-N 3.07Å
61	D	66.7	Low	75	Confident	82 Å²	82	122.7 Å²	122.7	44%	0.439	59%	0.589	S	S	.	*			trans	-47.6	118.7	175	-57.7	-49.9	0	0	0	107.2	D59 K63	D59-D61 PolarHBondContact O-N 2.87Å; D61-K63 HydrophobicContact CB-CB 4.03Å; D61-K63 PolarHBondContact O-N 2.62Å
62	N	68.2	Low	75.8	Confident	153 Å²	153	120 Å²	120	82%	0.818	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	7	177.1	-68.2	-39.5	0	0	0	113.2	F60 Y64	F60-N62 PolarHBondContact O-N 3.07Å; N62-Y64 PolarHBondContact O-N 2.78Å
63	K	73.9	Confident	76.5	Confident	155 Å²	155	120.6 Å²	120.6	67%	0.674	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50	-36.2	174	-176.7	179.9	-179.9	-173.8	0	113.1	D61	D61-K63 HydrophobicContact CB-CB 4.03Å; D61-K63 PolarHBondContact O-N 2.62Å
64	Y	78.4	Confident	77.2	Confident	184 Å²	184	116.9 Å²	116.9	72%	0.722	55%	0.553	S	S	*	*			trans	-100.1	96.5	-177.2	-54.9	-66.2	0	0	0	110.9	N62	N62-Y64 PolarHBondContact O-N 2.78Å
65	R	78.2	Confident	77.8	Confident	153 Å²	153	115.3 Å²	115.3	58%	0.577	55%	0.551	S	S	*	*			trans	-85.4	135.5	169.2	-64	-173.4	-177.6	-146.8	3.2	110.2	G67 R68	R65-G67 PolarHBondContact O-N 3.23Å; R65-R68 HydrophobicContact CB-CB 4.34Å; R65-R68 HydrophobicContact CB-CG 4Å; R65-R68 PolarHBondContact O-N 3.44Å
66	P	77.4	Confident	78.9	Confident	115 Å²	115	109.9 Å²	109.9	75%	0.747	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	137.2	176.2	26.1	-33.8	0	0	0	110.3	R68	P66-R68 VanDerWaalsContact C-N 3.31Å; P66-R68 PolarHBondContact O-N 3.18Å
67	G	82.3	Confident	79.9	Confident	52 Å²	52	108.4 Å²	108.4	54%	0.536	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	-6.8	-179	0	0	0	0	0	115.6	R65	R65-G67 PolarHBondContact O-N 3.23Å
68	R	82.3	Confident	81	Confident	130 Å²	130	110.5 Å²	110.5	49%	0.491	56%	0.555	S	S	.	*			trans	-95.2	122.8	175.9	-69.2	-72.5	-175.5	174.2	-4.9	110.7	D28 R65 P66	D28-R68 PolarHBondContact O-NH1 2.73Å; D28-R68 PolarHBondContact O-NH2 3.24Å; R65-R68 HydrophobicContact CB-CB 4.34Å; R65-R68 HydrophobicContact CB-CG 4Å; R65-R68 PolarHBondContact O-N 3.44Å; P66-R68 VanDerWaalsContact C-N 3.31Å; P66-R68 PolarHBondContact O-N 3.18Å
69	I	86.5	Confident	81.9	Confident	29 Å²	29	110.3 Å²	110.3	15%	0.149	55%	0.548	C	S	.	.			trans	-114.9	125.8	176.5	-64	176	0	0	0	108.5	L73 R74 P85	I69-L73 HydrophobicContact CG2-CB 3.99Å; I69-L73 HydrophobicContact CG2-CD2 4.01Å; I69-L73 HydrophobicContact CG2-CG 3.96Å; I69-R74 HydrophobicContact CG2-CB 4.2Å; I69-P85 HydrophobicContact CD1-CB 4.03Å; I69-P85 HydrophobicContact CD1-CG 3.25Å
70	S	86.9	Confident	82.9	Confident	69 Å²	69	106.8 Å²	106.8	48%	0.483	54%	0.535	S	S	.	.			trans	-61.7	151.2	175.6	70.5	0	0	0	0	112.1	E72 L73 R74	S70-E72 PolarHBondContact O-N 3.06Å; S70-L73 PolarHBondContact O-N 3.08Å; S70-L73 VanDerWaalsContact OG-CB 3.28Å; S70-L73 WeakPolarHBondContact OG-CB 3.47Å; S70-L73 PolarHBondContact OG-N 3.03Å; S70-R74 WeakPolarHBondContact O-CB 3.37Å; S70-R74 PolarHBondContact O-N 2.94Å
71	R	86.8	Confident	84	Confident	196 Å²	196	103 Å²	103	74%	0.74	53%	0.525	S	S	*	.	H	α-helix	trans	-58	-35	176.9	-174.2	176.8	174.6	-162.6	-0.5	112.8	R74 K75	R71-R74 PolarHBondContact O-N 3.42Å; R71-K75 WeakPolarHBondContact O-CG 3.39Å; R71-K75 PolarHBondContact O-N 2.98Å; R71-K75 VanDerWaalsContact O-N 3.09Å
72	E	90.4	Very high	84.9	Confident	160 Å²	160	105.8 Å²	105.8	75%	0.748	54%	0.536	S	S	*	.	H	α-helix	trans	-65.8	-50	176.9	-173.5	-179.3	176.5	0	0	111.6	S70 R74 K75 A76	S70-E72 PolarHBondContact O-N 3.06Å; E72-R74 PolarHBondContact O-N 3.43Å; E72-K75 WeakPolarHBondContact O-CB 3.2Å; E72-K75 PolarHBondContact O-N 3.26Å; E72-A76 PolarHBondContact O-N 2.7Å
73	L	90.2	Very high	85.8	Confident	85 Å²	85	101.3 Å²	101.3	45%	0.445	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-35.8	176.4	-178.9	57.2	0	0	0	111.8	I69 S70 A76 L77	I69-L73 HydrophobicContact CG2-CB 3.99Å; I69-L73 HydrophobicContact CG2-CD2 4.01Å; I69-L73 HydrophobicContact CG2-CG 3.96Å; S70-L73 PolarHBondContact O-N 3.08Å; S70-L73 VanDerWaalsContact OG-CB 3.28Å; S70-L73 WeakPolarHBondContact OG-CB 3.47Å; S70-L73 PolarHBondContact OG-N 3.03Å; L73-A76 WeakPolarHBondContact O-CB 3.49Å; L73-A76 PolarHBondContact O-N 3.45Å; L73-L77 HydrophobicContact CD1-CD1 4.34Å; L73-L77 HydrophobicContact CD1-CG 4.27Å; L73-L77 HydrophobicContact CG-CD1 4.23Å; L73-L77 WeakPolarHBondContact O-CG 3.32Å; L73-L77 PolarHBondContact O-N 2.93Å
74	R	89.9	Confident	86.5	Confident	14 Å²	14	95.2 Å²	95.2	5%	0.053	49%	0.486	C	S	.	.	H	α-helix	trans	-64.5	-43.2	177.6	-160.9	175.5	-175.6	89.3	-6.6	112.3	I69 S70 R71 E72 L77 N78 L79 S80 S81 D83	I69-R74 HydrophobicContact CG2-CB 4.2Å; S70-R74 WeakPolarHBondContact O-CB 3.37Å; S70-R74 PolarHBondContact O-N 2.94Å; R71-R74 PolarHBondContact O-N 3.42Å; E72-R74 PolarHBondContact O-N 3.43Å; R74-L77 PolarHBondContact O-N 2.7Å; R74-N78 PolarHBondContact O-N 3.16Å; R74-L79 HydrophobicContact CG-CB 3.66Å; R74-L79 WeakPolarHBondContact CG-O 3.3Å; R74-L79 PolarHBondContact O-N 2.74Å; R74-S80 PolarHBondContact NE-O 3.08Å; R74-S80 PolarHBondContact NH2-O 3.39Å; R74-S81 PolarHBondContact NH2-O 3.24Å; R74-D83 PolarHBondContact NH1-O 3.15Å; R74-D83 PolarHBondContact NH2-O 3.45Å
75	K	89.5	Confident	87	Confident	135 Å²	135	86.6 Å²	86.6	59%	0.587	45%	0.453	S	S	*	.	H	α-helix	trans	-61.1	-43.9	171	-70.7	176.3	-179.3	-176.9	0	111.4	R71 E72 L77 N78	R71-K75 WeakPolarHBondContact O-CG 3.39Å; R71-K75 PolarHBondContact O-N 2.98Å; R71-K75 VanDerWaalsContact O-N 3.09Å; E72-K75 WeakPolarHBondContact O-CB 3.2Å; E72-K75 PolarHBondContact O-N 3.26Å; K75-L77 PolarHBondContact O-N 3.26Å; K75-N78 PolarHBondContact O-N 2.95Å
76	A	93.5	Very high	87.5	Confident	75 Å²	75	82.4 Å²	82.4	62%	0.62	44%	0.441	S	S	*	.	H	α-helix	trans	-62.3	-32.1	178.3	0	0	0	0	0	112.8	E72 L73 N78	E72-A76 PolarHBondContact O-N 2.7Å; L73-A76 WeakPolarHBondContact O-CB 3.49Å; L73-A76 PolarHBondContact O-N 3.45Å; A76-N78 VanDerWaalsContact C-N 3.3Å
77	L	89.9	Confident	88	Confident	88 Å²	88	80.9 Å²	80.9	46%	0.461	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2.8	174.7	-68	177	0	0	0	114	L73 R74 K75 L79	L73-L77 HydrophobicContact CD1-CD1 4.34Å; L73-L77 HydrophobicContact CD1-CG 4.27Å; L73-L77 HydrophobicContact CG-CD1 4.23Å; L73-L77 WeakPolarHBondContact O-CG 3.32Å; L73-L77 PolarHBondContact O-N 2.93Å; R74-L77 PolarHBondContact O-N 2.7Å; K75-L77 PolarHBondContact O-N 3.26Å; L77-L79 VanDerWaalsContact C-N 3.27Å; L77-L79 HydrophobicContact CB-CD1 3.89Å; L77-L79 HydrophobicContact CB-CG 3.93Å; L77-L79 HydrophobicContact CD1-CD1 4.13Å; L77-L79 PolarHBondContact O-N 3.11Å
78	N	91.4	Very high	88.3	Confident	126 Å²	126	79 Å²	79	67%	0.674	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	40	-175.3	-61.9	-53.8	0	0	0	113.6	R74 K75 A76	R74-N78 PolarHBondContact O-N 3.16Å; K75-N78 PolarHBondContact O-N 2.95Å; A76-N78 VanDerWaalsContact C-N 3.3Å
79	L	89	Confident	88.5	Confident	35 Å²	35	77.1 Å²	77.1	18%	0.183	40%	0.395	C	S	.	.			trans	-101.9	132.2	177.4	-63.4	174.1	0	0	0	110.4	R74 L77 D83 P85	R74-L79 HydrophobicContact CG-CB 3.66Å; R74-L79 WeakPolarHBondContact CG-O 3.3Å; R74-L79 PolarHBondContact O-N 2.74Å; L77-L79 VanDerWaalsContact C-N 3.27Å; L77-L79 HydrophobicContact CB-CD1 3.89Å; L77-L79 HydrophobicContact CB-CG 3.93Å; L77-L79 HydrophobicContact CD1-CD1 4.13Å; L77-L79 PolarHBondContact O-N 3.11Å; L79-D83 HydrophobicContact CB-CB 4.25Å; L79-D83 HydrophobicContact CD2-CB 4.07Å; L79-P85 HydrophobicContact CD1-CB 4.03Å; L79-P85 HydrophobicContact CD1-CG 4.07Å
80	S	88.6	Confident	88.6	Confident	68 Å²	68	82.9 Å²	82.9	48%	0.476	42%	0.415	S	S	.	.			trans	-68.5	161.8	168.8	-179.2	0	0	0	0	110.5	R74 H82 D83	R74-S80 PolarHBondContact NE-O 3.08Å; R74-S80 PolarHBondContact NH2-O 3.39Å; S80-H82 PolarHBondContact O-N 3.16Å; S80-D83 WeakPolarHBondContact CB-OD1 3.43Å; S80-D83 VanDerWaalsContact CB-OD2 3.26Å; S80-D83 WeakPolarHBondContact CB-OD2 3.36Å; S80-D83 PolarHBondContact N-OD2 3.12Å; S80-D83 PolarHBondContact O-N 2.96Å
81	S	84.4	Confident	88.6	Confident	59 Å²	59	82 Å²	82	41%	0.413	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-22.3	-176.6	54.8	0	0	0	0	115	F29 R74	F29-S81 WeakPolarHBondContact CE2-O 3.26Å; R74-S81 PolarHBondContact NH2-O 3.24Å
82	H	84.8	Confident	88.5	Confident	141 Å²	141	78.6 Å²	78.6	65%	0.653	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-9.8	-178.4	-55.7	95.7	0	0	0	113.9	S80	S80-H82 PolarHBondContact O-N 3.16Å
83	D	88	Confident	88.4	Confident	58 Å²	58	76 Å²	76	31%	0.31	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-66.4	136.7	-177.4	-60.4	-5.7	0	0	0	114.5	R74 L79 S80 P85	R74-D83 PolarHBondContact NH1-O 3.15Å; R74-D83 PolarHBondContact NH2-O 3.45Å; L79-D83 HydrophobicContact CB-CB 4.25Å; L79-D83 HydrophobicContact CD2-CB 4.07Å; S80-D83 WeakPolarHBondContact CB-OD1 3.43Å; S80-D83 VanDerWaalsContact CB-OD2 3.26Å; S80-D83 WeakPolarHBondContact CB-OD2 3.36Å; S80-D83 PolarHBondContact N-OD2 3.12Å; S80-D83 PolarHBondContact O-N 2.96Å; D83-P85 WeakPolarHBondContact O-CD 3.49Å
84	I	87.8	Confident	88.3	Confident	27 Å²	27	79.1 Å²	79.1	14%	0.138	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-82	125.8	174.6	-53.2	-174.8	0	0	0	109.3	I25 Y27 I88 Y89	I25-I84 HydrophobicContact CD1-CD1 3.74Å; Y27-I84 HydrophobicContact CE2-CB 4.4Å; Y27-I84 HydrophobicContact CE2-CD1 4.46Å; Y27-I84 HydrophobicContact CE2-CG1 4Å; Y27-I84 HydrophobicContact CE2-CG2 4.04Å; I84-I88 HydrophobicContact CG2-CB 3.58Å; I84-I88 HydrophobicContact CG2-CG1 3.82Å; I84-I88 HydrophobicContact CG2-CG2 3.71Å; I84-Y89 HydrophobicContact CB-CE2 3.92Å; I84-Y89 HydrophobicContact CG2-CE2 4.1Å
85	P	89.6	Confident	88.2	Confident	4 Å²	4	80.2 Å²	80.2	3%	0.026	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-59.4	143.6	177	-21.2	29.5	0	0	0	113.1	I69 L79 D83 H87 I88	I69-P85 HydrophobicContact CD1-CB 4.03Å; I69-P85 HydrophobicContact CD1-CG 3.25Å; L79-P85 HydrophobicContact CD1-CB 4.03Å; L79-P85 HydrophobicContact CD1-CG 4.07Å; D83-P85 WeakPolarHBondContact O-CD 3.49Å; P85-H87 WeakPolarHBondContact CB-CE1 3.42Å; P85-H87 PolarHBondContact O-N 3.09Å; P85-H87 VanDerWaalsContact O-N 3.09Å; P85-I88 HydrophobicContact CB-CG1 4.26Å; P85-I88 HydrophobicContact CG-CG1 4.35Å; P85-I88 VanDerWaalsContact O-CB 3.3Å; P85-I88 WeakPolarHBondContact O-CB 3.36Å; P85-I88 WeakPolarHBondContact O-CG1 3.48Å; P85-I88 PolarHBondContact O-N 2.57Å
86	I	89.1	Confident	87.9	Confident	64 Å²	64	78.3 Å²	78.3	33%	0.328	41%	0.408	S	S	.	.	H	α-helix	trans	-55.4	-34.1	-176.5	-171.4	58.4	0	0	0	114.3	F9 I88 Y89 R90	F9-I86 HydrophobicContact CB-CD1 4.07Å; F9-I86 HydrophobicContact CD1-CD1 4.17Å; F9-I86 HydrophobicContact CG-CD1 4.07Å; I86-I88 PolarHBondContact O-N 2.92Å; I86-Y89 PolarHBondContact O-N 3.26Å; I86-Y89 VanDerWaalsContact O-N 3.16Å; I86-R90 PolarHBondContact O-N 3.31Å; I86-R90 VanDerWaalsContact O-N 3.12Å
87	H	87	Confident	87.4	Confident	84 Å²	84	77.4 Å²	77.4	39%	0.389	40%	0.396	S	S	.	.	H	α-helix	trans	-66	-24.1	-179.9	59	-99	0	0	0	112.6	P85 R90 M91	P85-H87 WeakPolarHBondContact CB-CE1 3.42Å; P85-H87 PolarHBondContact O-N 3.09Å; P85-H87 VanDerWaalsContact O-N 3.09Å; H87-R90 PolarHBondContact O-N 3.42Å; H87-M91 WeakPolarHBondContact O-CG 3.49Å; H87-M91 PolarHBondContact O-N 3.44Å
88	I	88.6	Confident	86.9	Confident	13 Å²	13	76.6 Å²	76.6	7%	0.067	40%	0.396	C	S	.	.	H	α-helix	trans	-66.8	-45.2	173.5	-54.7	-63.1	0	0	0	110.3	Y27 I84 P85 I86 R90 M91 R92	Y27-I88 WeakPolarHBondContact OH-CG1 3.42Å; Y27-I88 WeakPolarHBondContact OH-CG2 2.79Å; I84-I88 HydrophobicContact CG2-CB 3.58Å; I84-I88 HydrophobicContact CG2-CG1 3.82Å; I84-I88 HydrophobicContact CG2-CG2 3.71Å; P85-I88 HydrophobicContact CB-CG1 4.26Å; P85-I88 HydrophobicContact CG-CG1 4.35Å; P85-I88 VanDerWaalsContact O-CB 3.3Å; P85-I88 WeakPolarHBondContact O-CB 3.36Å; P85-I88 WeakPolarHBondContact O-CG1 3.48Å; P85-I88 PolarHBondContact O-N 2.57Å; I86-I88 PolarHBondContact O-N 2.92Å; I88-R90 VanDerWaalsContact C-N 3.31Å; I88-R90 PolarHBondContact O-N 2.86Å; I88-M91 HydrophobicContact CD1-CE 3.49Å; I88-M91 VanDerWaalsContact CD1-CE 3.49Å; I88-M91 WeakPolarHBondContact O-CB 3.26Å; I88-M91 PolarHBondContact O-N 3.3Å; I88-M91 VanDerWaalsContact O-N 3.15Å; I88-R92 WeakPolarHBondContact O-CG 3.4Å; I88-R92 PolarHBondContact O-N 2.68Å
89	Y	87.8	Confident	86.6	Confident	90 Å²	90	73 Å²	73	35%	0.353	39%	0.388	S	S	.	.	H	α-helix	trans	-61	-42.4	175.4	-70.6	-70.4	0	0	0	111.4	I84 I86 M91 R92 T93	I84-Y89 HydrophobicContact CB-CE2 3.92Å; I84-Y89 HydrophobicContact CG2-CE2 4.1Å; I86-Y89 PolarHBondContact O-N 3.26Å; I86-Y89 VanDerWaalsContact O-N 3.16Å; Y89-M91 VanDerWaalsContact C-N 3.32Å; Y89-M91 PolarHBondContact O-N 2.91Å; Y89-R92 WeakPolarHBondContact O-CB 3.39Å; Y89-R92 PolarHBondContact O-N 3.32Å; Y89-R92 VanDerWaalsContact O-N 3.08Å; Y89-T93 PolarHBondContact O-N 3.11Å; Y89-T93 VanDerWaalsContact O-N 3.11Å; Y89-T93 PolarHBondContact O-OG1 2.9Å
90	R	88.7	Confident	86.1	Confident	150 Å²	150	77.4 Å²	77.4	57%	0.566	40%	0.402	S	S	*	.	H	α-helix	trans	-59.6	-41.9	173.8	-65.7	179.7	179.7	-174.5	-2	112.1	I86 H87 I88 R92 T93 L94	I86-R90 PolarHBondContact O-N 3.31Å; I86-R90 VanDerWaalsContact O-N 3.12Å; H87-R90 PolarHBondContact O-N 3.42Å; I88-R90 VanDerWaalsContact C-N 3.31Å; I88-R90 PolarHBondContact O-N 2.86Å; R90-R92 VanDerWaalsContact C-N 3.31Å; R90-R92 PolarHBondContact O-N 3.38Å; R90-T93 PolarHBondContact O-N 3.04Å; R90-L94 WeakPolarHBondContact O-CB 3.49Å; R90-L94 VanDerWaalsContact O-CG 3.26Å; R90-L94 WeakPolarHBondContact O-CG 3.26Å; R90-L94 PolarHBondContact O-N 3.4Å
91	M	85.6	Confident	85.6	Confident	50 Å²	50	76.2 Å²	76.2	25%	0.246	39%	0.39	C	S	.	.	H	α-helix	trans	-65.1	-32.9	175	-74.5	-170.6	-60.8	0	0	112.8	H87 I88 Y89 T93 G95 Y96 W100	H87-M91 WeakPolarHBondContact O-CG 3.49Å; H87-M91 PolarHBondContact O-N 3.44Å; I88-M91 HydrophobicContact CD1-CE 3.49Å; I88-M91 VanDerWaalsContact CD1-CE 3.49Å; I88-M91 WeakPolarHBondContact O-CB 3.26Å; I88-M91 PolarHBondContact O-N 3.3Å; I88-M91 VanDerWaalsContact O-N 3.15Å; Y89-M91 VanDerWaalsContact C-N 3.32Å; Y89-M91 PolarHBondContact O-N 2.91Å; M91-T93 VanDerWaalsContact C-N 3.34Å; M91-G95 CarbonylContact O-C 3.2Å; M91-G95 VanDerWaalsContact O-CA 3.26Å; M91-G95 WeakPolarHBondContact O-CA 3.33Å; M91-G95 PolarHBondContact O-N 3.26Å; M91-Y96 HydrophobicContact CB-CD1 4.38Å; M91-Y96 HydrophobicContact CB-CE1 4.1Å; M91-Y96 HydrophobicContact CE-CE1 4.48Å; M91-W100 HydrophobicContact SD-CZ3 4.27Å
92	R	85.9	Confident	85.3	Confident	124 Å²	124	82 Å²	82	47%	0.468	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-40.6	174.2	-69.9	177.3	179	175.9	-0.1	111.5	I88 Y89 R90	I88-R92 WeakPolarHBondContact O-CG 3.4Å; I88-R92 PolarHBondContact O-N 2.68Å; Y89-R92 WeakPolarHBondContact O-CB 3.39Å; Y89-R92 PolarHBondContact O-N 3.32Å; Y89-R92 VanDerWaalsContact O-N 3.08Å; R90-R92 VanDerWaalsContact C-N 3.31Å; R90-R92 PolarHBondContact O-N 3.38Å
93	T	87.5	Confident	84.8	Confident	106 Å²	106	83.9 Å²	83.9	65%	0.65	41%	0.414	S	S	*	.	H	α-helix	trans	-74.5	-40.7	178.5	-47.7	0	0	0	0	112.6	Y89 R90 M91	Y89-T93 PolarHBondContact O-N 3.11Å; Y89-T93 VanDerWaalsContact O-N 3.11Å; Y89-T93 PolarHBondContact O-OG1 2.9Å; R90-T93 PolarHBondContact O-N 3.04Å; M91-T93 VanDerWaalsContact C-N 3.34Å
94	L	88.1	Confident	83.9	Confident	150 Å²	150	84.5 Å²	84.5	79%	0.785	43%	0.427	S	S	*	.	H	α-helix	trans	-82.1	-18.1	-178.1	-65.1	173.9	0	0	0	113.4	R90	R90-L94 WeakPolarHBondContact O-CB 3.49Å; R90-L94 VanDerWaalsContact O-CG 3.26Å; R90-L94 WeakPolarHBondContact O-CG 3.26Å; R90-L94 PolarHBondContact O-N 3.4Å
95	G	86.9	Confident	83.1	Confident	38 Å²	38	86.1 Å²	86.1	39%	0.392	45%	0.445	S	S	.	.			trans	89.5	156.9	-170.7	0	0	0	0	0	113.1	M91	M91-G95 CarbonylContact O-C 3.2Å; M91-G95 VanDerWaalsContact O-CA 3.26Å; M91-G95 WeakPolarHBondContact O-CA 3.33Å; M91-G95 PolarHBondContact O-N 3.26Å
96	Y	83.9	Confident	81.9	Confident	95 Å²	95	92 Å²	92	37%	0.373	48%	0.48	S	S	.	.			trans	-86	148.2	177.5	-65.9	-83	0	0	0	111.5	M91 W100	M91-Y96 HydrophobicContact CB-CD1 4.38Å; M91-Y96 HydrophobicContact CB-CE1 4.1Å; M91-Y96 HydrophobicContact CE-CE1 4.48Å; Y96-W100 HydrophobicContact CD1-CE3 4.45Å
97	P	82.8	Confident	80.4	Confident	55 Å²	55	91.9 Å²	91.9	36%	0.357	50%	0.496	S	S	.	.			trans	-48.7	135.5	172.6	-29.1	34	0	0	0	112.6	G99 W100 L101	P97-G99 PolarHBondContact O-N 2.88Å; P97-G99 VanDerWaalsContact O-N 3.1Å; P97-W100 HydrophobicContact CB-CD2 4.18Å; P97-W100 HydrophobicContact CB-CE3 4.29Å; P97-W100 HydrophobicContact CB-CG 4.42Å; P97-W100 HydrophobicContact CG-CD2 4.09Å; P97-W100 HydrophobicContact CG-CE3 3.75Å; P97-W100 HydrophobicContact CG-CH2 4.26Å; P97-W100 HydrophobicContact CG-CZ3 3.84Å; P97-W100 WeakPolarHBondContact O-CB 2.91Å; P97-W100 PolarHBondContact O-N 3.29Å; P97-L101 PolarHBondContact O-N 3.07Å
98	P	80.3	Confident	79.1	Confident	72 Å²	72	91.9 Å²	91.9	47%	0.468	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-27.3	-172.8	23	-33.9	0	0	0	113.3	W100 L101	P98-W100 PolarHBondContact O-N 3.46Å; P98-L101 PolarHBondContact O-N 2.79Å
99	G	83.8	Confident	77.3	Confident	49 Å²	49	95.4 Å²	95.4	51%	0.505	54%	0.543	S	S	.	.	H	α-helix	trans	-66.7	-21.7	174.3	0	0	0	0	0	114.3	P97	P97-G99 PolarHBondContact O-N 2.88Å; P97-G99 VanDerWaalsContact O-N 3.1Å
100	W	78.2	Confident	76.1	Confident	129 Å²	129	98.6 Å²	98.6	49%	0.489	57%	0.565	S	S	.	*	H	α-helix	trans	-89.7	-35.1	176.6	-64.4	-12.5	0	0	0	112	M91 Y96 P97 P98 K102 K103 A104	M91-W100 HydrophobicContact SD-CZ3 4.27Å; Y96-W100 HydrophobicContact CD1-CE3 4.45Å; P97-W100 HydrophobicContact CB-CD2 4.18Å; P97-W100 HydrophobicContact CB-CE3 4.29Å; P97-W100 HydrophobicContact CB-CG 4.42Å; P97-W100 HydrophobicContact CG-CD2 4.09Å; P97-W100 HydrophobicContact CG-CE3 3.75Å; P97-W100 HydrophobicContact CG-CH2 4.26Å; P97-W100 HydrophobicContact CG-CZ3 3.84Å; P97-W100 WeakPolarHBondContact O-CB 2.91Å; P97-W100 PolarHBondContact O-N 3.29Å; P98-W100 PolarHBondContact O-N 3.46Å; W100-K102 VanDerWaalsContact C-N 3.31Å; W100-K102 PolarHBondContact O-N 2.85Å; W100-K103 PolarHBondContact O-N 2.97Å; W100-K103 VanDerWaalsContact O-N 3.11Å; W100-A104 WeakPolarHBondContact O-CB 3.33Å; W100-A104 PolarHBondContact O-N 3.45Å
101	L	78.9	Confident	74.9	Confident	43 Å²	43	95.2 Å²	95.2	23%	0.225	56%	0.558	C	S	.	*	H	α-helix	trans	-57.7	-41.2	179.9	-68.1	178.2	0	0	0	112.8	P97 P98 K103 A104 A105	P97-L101 PolarHBondContact O-N 3.07Å; P98-L101 PolarHBondContact O-N 2.79Å; L101-K103 VanDerWaalsContact C-N 3.28Å; L101-K103 PolarHBondContact O-N 3.46Å; L101-A104 CarbonylContact O-C 3.6Å; L101-A104 PolarHBondContact O-N 3.48Å; L101-A105 WeakPolarHBondContact O-CB 3.47Å; L101-A105 PolarHBondContact O-N 2.9Å
102	K	78.3	Confident	74	Confident	181 Å²	181	100.4 Å²	100.4	79%	0.787	58%	0.583	S	S	*	*	H	α-helix	trans	-61.2	-35	178.3	-67.6	-175	-179.8	-178.5	0	113.4	W100	W100-K102 VanDerWaalsContact C-N 3.31Å; W100-K102 PolarHBondContact O-N 2.85Å
103	K	73.8	Confident	73.1	Confident	179 Å²	179	103.3 Å²	103.3	78%	0.778	60%	0.6	S	S	*	*	H	α-helix	trans	-81	-35.3	177.7	-64.7	-178.3	179.1	-177.8	0	111.7	W100 L101 A105	W100-K103 PolarHBondContact O-N 2.97Å; W100-K103 VanDerWaalsContact O-N 3.11Å; L101-K103 VanDerWaalsContact C-N 3.28Å; L101-K103 PolarHBondContact O-N 3.46Å; K103-A105 VanDerWaalsContact C-N 3.28Å
104	A	70.1	Confident	72.4	Confident	71 Å²	71	104.1 Å²	104.1	59%	0.587	60%	0.6	S	S	*	*	H	α-helix	trans	-79.4	-10.4	180	0	0	0	0	0	113.3	W100 L101 V106	W100-A104 WeakPolarHBondContact O-CB 3.33Å; W100-A104 PolarHBondContact O-N 3.45Å; L101-A104 CarbonylContact O-C 3.6Å; L101-A104 PolarHBondContact O-N 3.48Å; A104-V106 PolarHBondContact O-N 2.72Å
105	A	70.6	Confident	71.4	Confident	61 Å²	61	102.3 Å²	102.3	50%	0.504	60%	0.6	S	S	.	*			trans	-67.9	66.8	167.5	0	0	0	0	0	109.9	L101 K103 G107	L101-A105 WeakPolarHBondContact O-CB 3.47Å; L101-A105 PolarHBondContact O-N 2.9Å; K103-A105 VanDerWaalsContact C-N 3.28Å; A105-G107 PolarHBondContact O-N 3.26Å
106	V	64.5	Low	70.2	Confident	127 Å²	127	105 Å²	105	77%	0.77	61%	0.605	S	S	*	*			trans	-64.9	126.2	159.1	-174.2	0	0	0	0	104.9	A104 G108	A104-V106 PolarHBondContact O-N 2.72Å; V106-G108 PolarHBondContact O-N 3.47Å; V106-G108 VanDerWaalsContact O-N 3.16Å
107	G	56.8	Low	68.8	Low	63 Å²	63	107 Å²	107	65%	0.649	62%	0.623	S	S	*	*			trans	-40.1	122.2	-169.5	0	0	0	0	0	111.7	A105 C109	A105-G107 PolarHBondContact O-N 3.26Å; G107-C109 VanDerWaalsContact C-N 3.26Å; G107-C109 VanDerWaalsContact O-CB 3.32Å; G107-C109 WeakPolarHBondContact O-CB 3.28Å; G107-C109 PolarHBondContact O-N 3.38Å
108	G	59.3	Low	67.3	Low	83 Å²	83	110 Å²	110	86%	0.856	64%	0.64	S	S	*	*	S	Bend	trans	-57.8	81.1	-170.1	0	0	0	0	0	113.3	V106	V106-G108 PolarHBondContact O-N 3.47Å; V106-G108 VanDerWaalsContact O-N 3.16Å
109	C	52.5	Low	66.2	Low	87 Å²	87	114 Å²	114	59%	0.588	66%	0.658	S	S	*	*			trans	-142.7	55.1	-170.2	-164.4	0	0	0	0	108.3	G107 L111	G107-C109 VanDerWaalsContact C-N 3.26Å; G107-C109 VanDerWaalsContact O-CB 3.32Å; G107-C109 WeakPolarHBondContact O-CB 3.28Å; G107-C109 PolarHBondContact O-N 3.38Å; C109-L111 PolarHBondContact O-N 3.37Å; C109-L111 WeakPolarHBondContact SG-CD1 3.44Å; C109-L111 WeakPolarHBondContact SG-CG 3.33Å
110	L	60.8	Low	64.6	Low	158 Å²	158	116 Å²	116	83%	0.827	66%	0.664	S	S	*	*			trans	-77.9	77.6	138.6	-171.4	71.9	0	0	0	104.7	M112	L110-M112 PolarHBondContact O-N 3.1Å
111	L	64	Low	63.5	Low	78 Å²	78	115.8 Å²	115.8	41%	0.408	67%	0.672	S	S	.	*			trans	-66.6	108.2	165.2	-72.1	169.1	0	0	0	105	C109 F113	C109-L111 PolarHBondContact O-N 3.37Å; C109-L111 WeakPolarHBondContact SG-CD1 3.44Å; C109-L111 WeakPolarHBondContact SG-CG 3.33Å; L111-F113 HydrophobicContact CB-CE2 4.29Å; L111-F113 HydrophobicContact CB-CZ 4.38Å; L111-F113 PolarHBondContact O-N 2.89Å; L111-F113 VanDerWaalsContact O-N 3.08Å
112	M	66	Low	62.3	Low	159 Å²	159	120.6 Å²	120.6	78%	0.783	69%	0.693	S	S	*	*			trans	-65.3	108.1	161	-71.8	-168.3	59.8	0	0	106	L110 D114	L110-M112 PolarHBondContact O-N 3.1Å; M112-D114 PolarHBondContact O-N 2.88Å
113	F	67.4	Low	61.1	Low	185 Å²	185	116.1 Å²	116.1	81%	0.811	69%	0.685	S	S	*	*			trans	-75.5	85.4	165.1	-66	-81.8	0	0	0	106.2	L111 S115	L111-F113 HydrophobicContact CB-CE2 4.29Å; L111-F113 HydrophobicContact CB-CZ 4.38Å; L111-F113 PolarHBondContact O-N 2.89Å; L111-F113 VanDerWaalsContact O-N 3.08Å; F113-S115 PolarHBondContact O-N 3.43Å
114	D	73.8	Confident	60.2	Low	123 Å²	123	113.4 Å²	113.4	66%	0.658	67%	0.674	S	S	*	*			trans	-67.1	126.6	161.6	-161.7	7.5	0	0	0	106.7	M112 D116	M112-D114 PolarHBondContact O-N 2.88Å; D114-D116 PolarHBondContact O-N 3.41Å; D114-D116 VanDerWaalsContact O-N 3.08Å
115	S	66	Low	59.2	Low	113 Å²	113	117.5 Å²	117.5	79%	0.79	68%	0.675	S	S	*	*	S	Bend	trans	-73.3	3.3	-177.8	59.3	0	0	0	0	112.8	F113	F113-S115 PolarHBondContact O-N 3.43Å
116	D	63.2	Low	58.5	Low	93 Å²	93	118.3 Å²	118.3	50%	0.497	67%	0.668	S	S	.	*	S	Bend	trans	-126	83.7	-159.4	-58.9	17.8	0	0	0	109.3	D114	D114-D116 PolarHBondContact O-N 3.41Å; D114-D116 VanDerWaalsContact O-N 3.08Å
117	N	54.3	Low	58	Low	139 Å²	139	118.5 Å²	118.5	74%	0.743	66%	0.661	S	S	*	*			trans	72.2	109.4	149.5	-40	-64	0	0	0	118.7
118	T	50.9	Low	57.7	Low	116 Å²	116	120 Å²	120	71%	0.712	65%	0.654	S	S	*	*			trans	65.5	104.2	136.6	55.8	0	0	0	0	119.4
119	D	55.8	Low	57.5	Low	158 Å²	158	121 Å²	121	85%	0.845	64%	0.635	S	S	*	*			trans	51.9	68.8	137.4	-55.7	-13.2	0	0	0	117.5
120	S	51	Low	57.5	Low	91 Å²	91	122.4 Å²	122.4	64%	0.636	63%	0.633	S	S	*	*			trans	-134.9	36.8	162.9	-61.8	0	0	0	0	112.6	E122	S120-E122 VanDerWaalsContact C-N 3.29Å; S120-E122 PolarHBondContact O-N 2.97Å
121	L	54.5	Low	56.9	Low	124 Å²	124	121.2 Å²	121.2	65%	0.649	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	17.6	-175.9	-64.6	-172.1	0	0	0	115.8
122	E	54	Low	56.3	Low	143 Å²	143	122 Å²	122	67%	0.668	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-24.4	180	-149.8	67.3	-133.4	0	0	114.2	S120 R125	S120-E122 VanDerWaalsContact C-N 3.29Å; S120-E122 PolarHBondContact O-N 2.97Å; E122-R125 IonicContact OE1-NH1 3.94Å
123	S	53.7	Low	55.6	Low	88 Å²	88	121.4 Å²	121.4	62%	0.615	62%	0.617	S	S	*	*	S	Bend	trans	-76.4	-33.6	-175.4	57.1	0	0	0	0	113.9	R125 E126	S123-R125 VanDerWaalsContact C-N 3.32Å; S123-R125 PolarHBondContact O-N 3.12Å; S123-E126 PolarHBondContact O-N 3.48Å
124	E	54	Low	54.8	Low	121 Å²	121	121.7 Å²	121.7	57%	0.565	61%	0.614	S	S	*	*	H	α-helix	trans	-74.9	-19.8	-174.7	-62.8	-175	177.2	0	0	113.7	E126 N128	E124-E126 VanDerWaalsContact C-N 3.28Å; E124-E126 PolarHBondContact O-N 3.49Å; E124-N128 PolarHBondContact O-N 3.2Å; E124-N128 PolarHBondContact O-ND2 3.48Å
125	R	49.9	Very low	53.4	Low	158 Å²	158	118.3 Å²	118.3	60%	0.596	60%	0.598	S	S	*	*	H	α-helix	trans	-67	-29.6	176.5	-93	-173	-177.1	136.9	3	112.6	E122 S123 K129	E122-R125 IonicContact OE1-NH1 3.94Å; S123-R125 VanDerWaalsContact C-N 3.32Å; S123-R125 PolarHBondContact O-N 3.12Å; R125-K129 VanDerWaalsContact O-CG 3.28Å; R125-K129 WeakPolarHBondContact O-CG 3.36Å; R125-K129 PolarHBondContact O-N 2.91Å
126	E	55.2	Low	52.6	Low	77 Å²	77	116.9 Å²	116.9	36%	0.36	59%	0.585	S	S	.	*	H	α-helix	trans	-84	-30.4	-176.6	-157.9	56.4	-148.5	0	0	112.4	S123 E124 K129 Q130 R133	S123-E126 PolarHBondContact O-N 3.48Å; E124-E126 VanDerWaalsContact C-N 3.28Å; E124-E126 PolarHBondContact O-N 3.49Å; E126-K129 PolarHBondContact O-N 3.1Å; E126-K129 WeakPolarHBondContact OE2-CD 3.46Å; E126-K129 IonicContact OE2-NZ 3.46Å; E126-K129 PolarHBondContact OE2-NZ 3.41Å; E126-Q130 VanDerWaalsContact O-CG 3.32Å; E126-Q130 WeakPolarHBondContact O-CG 3.4Å; E126-Q130 PolarHBondContact O-N 3.33Å; E126-Q130 VanDerWaalsContact O-N 3.12Å; E126-Q130 PolarHBondContact O-NE2 3.34Å; E126-R133 IonicContact OE1-NH2 3.92Å
127	E	54.1	Low	51.6	Low	132 Å²	132	119.6 Å²	119.6	62%	0.617	59%	0.592	S	S	*	*	H	α-helix	trans	-70.1	-43.6	176.9	-169.7	172.9	-169.6	0	0	111.9	K129 Q130 M131	E127-K129 VanDerWaalsContact C-N 3.29Å; E127-K129 PolarHBondContact O-N 2.98Å; E127-Q130 WeakPolarHBondContact O-CA 3.32Å; E127-Q130 WeakPolarHBondContact O-CB 3.33Å; E127-Q130 PolarHBondContact O-N 3.23Å; E127-M131 PolarHBondContact O-N 3.49Å
128	N	51.2	Low	51.2	Low	93 Å²	93	116.6 Å²	116.6	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-62.5	-36.1	175.7	-76.7	-53.5	0	0	0	112.5	E124 Q130 L132	E124-N128 PolarHBondContact O-N 3.2Å; E124-N128 PolarHBondContact O-ND2 3.48Å; N128-Q130 VanDerWaalsContact C-N 3.31Å; N128-Q130 PolarHBondContact O-N 2.85Å; N128-L132 PolarHBondContact O-N 2.83Å
129	K	54.4	Low	50.9	Low	106 Å²	106	114 Å²	114	46%	0.461	57%	0.569	S	S	.	*	H	α-helix	trans	-64.3	-36.4	171.4	-73.5	176.9	-153.9	158.9	0	111.8	R125 E126 E127 R133	R125-K129 VanDerWaalsContact O-CG 3.28Å; R125-K129 WeakPolarHBondContact O-CG 3.36Å; R125-K129 PolarHBondContact O-N 2.91Å; E126-K129 PolarHBondContact O-N 3.1Å; E126-K129 WeakPolarHBondContact OE2-CD 3.46Å; E126-K129 IonicContact OE2-NZ 3.46Å; E126-K129 PolarHBondContact OE2-NZ 3.41Å; E127-K129 VanDerWaalsContact C-N 3.29Å; E127-K129 PolarHBondContact O-N 2.98Å; K129-R133 WeakPolarHBondContact O-CB 3.38Å; K129-R133 WeakPolarHBondContact O-CG 3.49Å; K129-R133 PolarHBondContact O-N 3.44Å
130	Q	52.9	Low	50.4	Low	116 Å²	116	111.1 Å²	111.1	54%	0.542	56%	0.561	S	S	.	*	H	α-helix	trans	-70.1	-40.6	179.3	-73.9	177	61.9	0	0	112.3	E126 E127 N128 L132 R133 Y134	E126-Q130 VanDerWaalsContact O-CG 3.32Å; E126-Q130 WeakPolarHBondContact O-CG 3.4Å; E126-Q130 PolarHBondContact O-N 3.33Å; E126-Q130 VanDerWaalsContact O-N 3.12Å; E126-Q130 PolarHBondContact O-NE2 3.34Å; E127-Q130 WeakPolarHBondContact O-CA 3.32Å; E127-Q130 WeakPolarHBondContact O-CB 3.33Å; E127-Q130 PolarHBondContact O-N 3.23Å; N128-Q130 VanDerWaalsContact C-N 3.31Å; N128-Q130 PolarHBondContact O-N 2.85Å; Q130-L132 PolarHBondContact O-N 2.91Å; Q130-R133 CarbonylContact O-C 3.59Å; Q130-R133 WeakPolarHBondContact O-CA 3.35Å; Q130-R133 WeakPolarHBondContact O-CB 3.46Å; Q130-R133 PolarHBondContact O-N 3.07Å; Q130-Y134 PolarHBondContact O-N 3.03Å
131	M	47.5	Very low	50.2	Low	132 Å²	132	115.3 Å²	115.3	65%	0.65	57%	0.568	S	S	*	*	H	α-helix	trans	-63.3	-41.4	176.2	-166.3	177.1	-72	0	0	111.5	E127 R133 Y134	E127-M131 PolarHBondContact O-N 3.49Å; M131-R133 VanDerWaalsContact C-N 3.35Å; M131-Y134 PolarHBondContact O-N 2.9Å
132	L	52.6	Low	49.8	Very low	95 Å²	95	112.6 Å²	112.6	50%	0.497	56%	0.559	S	S	.	*	H	α-helix	trans	-67.3	-31.9	171.1	-70.4	173.6	0	0	0	112.6	N128 Q130 T135 V136	N128-L132 PolarHBondContact O-N 2.83Å; Q130-L132 PolarHBondContact O-N 2.91Å; L132-T135 PolarHBondContact O-OG1 3.4Å; L132-T135 VanDerWaalsContact O-OG1 3.1Å; L132-V136 WeakPolarHBondContact O-CG2 3.45Å; L132-V136 PolarHBondContact O-N 3.34Å
133	R	51.8	Low	49.7	Very low	147 Å²	147	107.6 Å²	107.6	56%	0.555	54%	0.54	S	S	*	.	H	α-helix	trans	-69.4	-34.2	174.3	-82	-153.1	-126.7	-167.9	6.8	113.4	E126 K129 Q130 M131 V136 K137	E126-R133 IonicContact OE1-NH2 3.92Å; K129-R133 WeakPolarHBondContact O-CB 3.38Å; K129-R133 WeakPolarHBondContact O-CG 3.49Å; K129-R133 PolarHBondContact O-N 3.44Å; Q130-R133 CarbonylContact O-C 3.59Å; Q130-R133 WeakPolarHBondContact O-CA 3.35Å; Q130-R133 WeakPolarHBondContact O-CB 3.46Å; Q130-R133 PolarHBondContact O-N 3.07Å; M131-R133 VanDerWaalsContact C-N 3.35Å; R133-V136 PolarHBondContact O-N 2.9Å; R133-K137 WeakPolarHBondContact O-CG 3.49Å; R133-K137 PolarHBondContact O-N 3.5Å
134	Y	50	Low	50	Low	190 Å²	190	108.4 Å²	108.4	75%	0.745	54%	0.543	S	S	*	.	H	α-helix	trans	-65.5	-40.9	-178.8	-165.9	-96.8	0	0	0	111.4	Q130 M131 K137 S138	Q130-Y134 PolarHBondContact O-N 3.03Å; M131-Y134 PolarHBondContact O-N 2.9Å; Y134-K137 PolarHBondContact O-N 2.58Å; Y134-S138 PolarHBondContact O-N 3.42Å
135	T	45	Very low	50.3	Low	53 Å²	53	109.4 Å²	109.4	33%	0.325	55%	0.552	S	S	.	*	H	α-helix	trans	-72.4	-30.1	178.1	65.4	0	0	0	0	112.8	L132 S138	L132-T135 PolarHBondContact O-OG1 3.4Å; L132-T135 VanDerWaalsContact O-OG1 3.1Å; T135-S138 PolarHBondContact O-OG 3.32Å
136	V	47.9	Very low	50.6	Low	82 Å²	82	107 Å²	107	50%	0.497	55%	0.55	S	S	.	*	H	α-helix	trans	-74	-30.9	173.4	175.8	0	0	0	0	111.4	L132 R133 S138 S139	L132-V136 WeakPolarHBondContact O-CG2 3.45Å; L132-V136 PolarHBondContact O-N 3.34Å; R133-V136 PolarHBondContact O-N 2.9Å; V136-S138 PolarHBondContact O-N 3.22Å; V136-S139 WeakPolarHBondContact O-CB 3.36Å; V136-S139 PolarHBondContact O-N 2.92Å; V136-S139 PolarHBondContact O-OG 3.06Å
137	K	43.2	Very low	51	Low	150 Å²	150	107.4 Å²	107.4	65%	0.652	55%	0.554	S	S	*	*	H	α-helix	trans	-68.2	-30.9	176.2	-78.2	178.1	-179.9	-179.6	0	113.3	R133 Y134 S139 S140	R133-K137 WeakPolarHBondContact O-CG 3.49Å; R133-K137 PolarHBondContact O-N 3.5Å; Y134-K137 PolarHBondContact O-N 2.58Å; K137-S139 PolarHBondContact O-N 2.83Å; K137-S140 WeakPolarHBondContact O-CB 3.43Å; K137-S140 PolarHBondContact O-N 3.46Å
138	S	44.9	Very low	51.9	Low	77 Å²	77	104.8 Å²	104.8	54%	0.538	55%	0.55	S	S	.	.	H	α-helix	trans	-70.1	-19.6	170.9	63.8	0	0	0	0	112.6	Y134 T135 V136 S140 F141	Y134-S138 PolarHBondContact O-N 3.42Å; T135-S138 PolarHBondContact O-OG 3.32Å; V136-S138 PolarHBondContact O-N 3.22Å; S138-S140 VanDerWaalsContact C-N 3.26Å; S138-S140 PolarHBondContact O-N 3.43Å; S138-F141 WeakPolarHBondContact O-CD2 3.45Å; S138-F141 PolarHBondContact O-N 3.43Å
139	S	46.1	Very low	53	Low	61 Å²	61	105.8 Å²	105.8	43%	0.427	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.7	-8.3	172	81.8	0	0	0	0	114.4	V136 K137 F141	V136-S139 WeakPolarHBondContact O-CB 3.36Å; V136-S139 PolarHBondContact O-N 2.92Å; V136-S139 PolarHBondContact O-OG 3.06Å; K137-S139 PolarHBondContact O-N 2.83Å; S139-F141 PolarHBondContact O-N 3.4Å
140	S	44.9	Very low	53.7	Low	97 Å²	97	106.5 Å²	106.5	68%	0.678	56%	0.559	S	S	*	*			trans	-72.2	55.3	154.1	-63.6	0	0	0	0	109.3	K137 S138 S142	K137-S140 WeakPolarHBondContact O-CB 3.43Å; K137-S140 PolarHBondContact O-N 3.46Å; S138-S140 VanDerWaalsContact C-N 3.26Å; S138-S140 PolarHBondContact O-N 3.43Å; S140-S142 PolarHBondContact O-N 2.76Å
141	F	45.6	Very low	54.9	Low	179 Å²	179	104.6 Å²	104.6	79%	0.785	56%	0.556	S	S	*	*			trans	-69.1	59.6	160.8	-121.2	-90.7	0	0	0	107	S138 S139 S143	S138-F141 WeakPolarHBondContact O-CD2 3.45Å; S138-F141 PolarHBondContact O-N 3.43Å; S139-F141 PolarHBondContact O-N 3.4Å; F141-S143 PolarHBondContact O-N 2.82Å
142	S	47.3	Very low	56.4	Low	68 Å²	68	106.8 Å²	106.8	48%	0.476	56%	0.557	S	S	.	*			trans	-69.9	78.8	161.8	-174.9	0	0	0	0	104.9	S140 I147	S140-S142 PolarHBondContact O-N 2.76Å; S142-I147 VanDerWaalsContact OG-CD1 3.24Å; S142-I147 WeakPolarHBondContact OG-CD1 3.24Å; S142-I147 WeakPolarHBondContact OG-CG1 3.37Å
143	S	51.6	Low	57.6	Low	37 Å²	37	110 Å²	110	26%	0.259	56%	0.562	S	S	.	*			trans	-53	130.7	-179.8	50.8	0	0	0	0	107.5	F141 L145 L146 I147	F141-S143 PolarHBondContact O-N 2.82Å; S143-L145 PolarHBondContact O-N 2.9Å; S143-L146 PolarHBondContact O-N 2.85Å; S143-L146 VanDerWaalsContact OG-CD1 3.29Å; S143-L146 WeakPolarHBondContact OG-CD1 3.48Å; S143-L146 WeakPolarHBondContact OG-CG 3.3Å; S143-I147 PolarHBondContact O-N 3.48Å
144	P	60.8	Low	58.9	Low	105 Å²	105	106.4 Å²	106.4	68%	0.682	55%	0.554	S	S	*	*	H	α-helix	trans	-56.5	-24.8	-171.4	17.9	-30.7	0	0	0	112.7	S148	P144-S148 PolarHBondContact O-N 3.32Å
145	L	58.8	Low	60.2	Low	143 Å²	143	103.2 Å²	103.2	75%	0.749	55%	0.546	S	S	*	.	H	α-helix	trans	-64.9	-38.5	174	-59.9	177.5	0	0	0	113.4	S143 S148 L149	S143-L145 PolarHBondContact O-N 2.9Å; L145-S148 PolarHBondContact O-N 3.49Å; L145-L149 PolarHBondContact O-N 3.2Å
146	L	57.3	Low	62	Low	107 Å²	107	104.2 Å²	104.2	56%	0.56	55%	0.552	S	S	*	*	H	α-helix	trans	-73.1	-37.1	180	-72.4	177	0	0	0	112	S143 S148 L149 H150	S143-L146 PolarHBondContact O-N 2.85Å; S143-L146 VanDerWaalsContact OG-CD1 3.29Å; S143-L146 WeakPolarHBondContact OG-CD1 3.48Å; S143-L146 WeakPolarHBondContact OG-CG 3.3Å; L146-S148 VanDerWaalsContact C-N 3.32Å; L146-L149 PolarHBondContact O-N 3.21Å; L146-H150 WeakPolarHBondContact O-CB 3.29Å; L146-H150 PolarHBondContact O-N 2.94Å
147	I	62.4	Low	63.4	Low	86 Å²	86	103.4 Å²	103.4	44%	0.441	54%	0.544	S	S	.	.	H	α-helix	trans	-61	-46.6	173.7	-55.5	168.5	0	0	0	109.3	S142 S143 L149 H150 V151	S142-I147 VanDerWaalsContact OG-CD1 3.24Å; S142-I147 WeakPolarHBondContact OG-CD1 3.24Å; S142-I147 WeakPolarHBondContact OG-CG1 3.37Å; S143-I147 PolarHBondContact O-N 3.48Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 2.89Å; I147-H150 PolarHBondContact O-N 3.15Å; I147-V151 HydrophobicContact CG2-CG2 4.2Å; I147-V151 WeakPolarHBondContact O-CB 3.33Å; I147-V151 VanDerWaalsContact O-CG2 3.26Å; I147-V151 WeakPolarHBondContact O-CG2 3.27Å; I147-V151 PolarHBondContact O-N 3.41Å
148	S	74.4	Confident	65.2	Low	76 Å²	76	101.2 Å²	101.2	53%	0.531	54%	0.54	S	S	.	.	H	α-helix	trans	-59	-43.8	177.7	-174.7	0	0	0	0	112.2	P144 L145 L146 R152	P144-S148 PolarHBondContact O-N 3.32Å; L145-S148 PolarHBondContact O-N 3.49Å; L146-S148 VanDerWaalsContact C-N 3.32Å; S148-R152 VanDerWaalsContact O-CB 3.24Å; S148-R152 WeakPolarHBondContact O-CB 3.41Å; S148-R152 PolarHBondContact O-N 3.44Å
149	L	73.2	Confident	66.8	Low	115 Å²	115	102.8 Å²	102.8	60%	0.602	54%	0.542	S	S	*	.	H	α-helix	trans	-65.8	-41.4	177.7	-168.7	68	0	0	0	112.1	L145 L146 I147 R152 W153	L145-L149 PolarHBondContact O-N 3.2Å; L146-L149 PolarHBondContact O-N 3.21Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 2.89Å; L149-R152 PolarHBondContact O-N 2.94Å; L149-W153 VanDerWaalsContact O-CB 3.3Å; L149-W153 WeakPolarHBondContact O-CB 3.26Å; L149-W153 PolarHBondContact O-N 3.44Å
150	H	70.2	Confident	68.1	Low	120 Å²	120	103.5 Å²	103.5	56%	0.556	54%	0.54	S	S	*	.	H	α-helix	trans	-69.3	-39.2	179.9	-156.8	-50.1	0	0	0	112.3	L146 I147 W153 N154	L146-H150 WeakPolarHBondContact O-CB 3.29Å; L146-H150 PolarHBondContact O-N 2.94Å; I147-H150 PolarHBondContact O-N 3.15Å; H150-W153 PolarHBondContact O-N 3.24Å; H150-N154 PolarHBondContact CE1-ND2 2.89Å; H150-N154 PolarHBondContact ND1-ND2 3.42Å; H150-N154 VanDerWaalsContact ND1-ND2 3.14Å; H150-N154 WeakPolarHBondContact O-CB 3.06Å; H150-N154 PolarHBondContact O-N 3.48Å; H150-N154 PolarHBondContact O-ND2 3.11Å
151	V	77	Confident	69.2	Low	76 Å²	76	103 Å²	103	46%	0.461	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-44.8	173.5	171.6	0	0	0	0	110	I147 W153 N154 Q155	I147-V151 HydrophobicContact CG2-CG2 4.2Å; I147-V151 WeakPolarHBondContact O-CB 3.33Å; I147-V151 VanDerWaalsContact O-CG2 3.26Å; I147-V151 WeakPolarHBondContact O-CG2 3.27Å; I147-V151 PolarHBondContact O-N 3.41Å; V151-W153 PolarHBondContact O-N 3.37Å; V151-N154 PolarHBondContact O-N 3.14Å; V151-Q155 WeakPolarHBondContact O-CG 3.37Å; V151-Q155 PolarHBondContact O-N 2.88Å
152	R	80.4	Confident	70.5	Confident	179 Å²	179	105.4 Å²	105.4	68%	0.675	53%	0.533	S	S	*	.	H	α-helix	trans	-65	-39.5	178.3	-166.5	170.3	-177	177.9	0.2	112.2	S148 L149 Q155 V156	S148-R152 VanDerWaalsContact O-CB 3.24Å; S148-R152 WeakPolarHBondContact O-CB 3.41Å; S148-R152 PolarHBondContact O-N 3.44Å; L149-R152 PolarHBondContact O-N 2.94Å; R152-Q155 PolarHBondContact O-N 3.49Å; R152-V156 WeakPolarHBondContact O-CG2 3.35Å; R152-V156 PolarHBondContact O-N 3.45Å
153	W	77.7	Confident	71.7	Confident	163 Å²	163	110 Å²	110	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-64.3	-44.8	175.2	-174.3	-99.8	0	0	0	112	L149 H150 V151 Q155 V156 L157	L149-W153 VanDerWaalsContact O-CB 3.3Å; L149-W153 WeakPolarHBondContact O-CB 3.26Å; L149-W153 PolarHBondContact O-N 3.44Å; H150-W153 PolarHBondContact O-N 3.24Å; V151-W153 PolarHBondContact O-N 3.37Å; W153-Q155 VanDerWaalsContact C-N 3.32Å; W153-Q155 PolarHBondContact O-N 2.96Å; W153-V156 PolarHBondContact O-N 2.84Å; W153-L157 VanDerWaalsContact NE1-CD1 3.35Å; W153-L157 PolarHBondContact O-N 2.68Å
154	N	77.7	Confident	72.5	Confident	71 Å²	71	112.8 Å²	112.8	38%	0.38	55%	0.552	S	S	.	*	H	α-helix	trans	-64.8	-35.2	176.1	-77.5	-19.7	0	0	0	112.6	H150 V151 N158	H150-N154 PolarHBondContact CE1-ND2 2.89Å; H150-N154 PolarHBondContact ND1-ND2 3.42Å; H150-N154 VanDerWaalsContact ND1-ND2 3.14Å; H150-N154 WeakPolarHBondContact O-CB 3.06Å; H150-N154 PolarHBondContact O-N 3.48Å; H150-N154 PolarHBondContact O-ND2 3.11Å; V151-N154 PolarHBondContact O-N 3.14Å; N154-N158 WeakPolarHBondContact O-CB 3.22Å; N154-N158 PolarHBondContact O-N 3.07Å; N154-N158 PolarHBondContact O-ND2 2.93Å
155	Q	78.7	Confident	73.2	Confident	123 Å²	123	114 Å²	114	58%	0.575	55%	0.549	S	S	*	.	H	α-helix	trans	-65	-42.1	172.8	-77.3	177.6	-33.1	0	0	111.9	V151 R152 W153 N158 L159	V151-Q155 WeakPolarHBondContact O-CG 3.37Å; V151-Q155 PolarHBondContact O-N 2.88Å; R152-Q155 PolarHBondContact O-N 3.49Å; W153-Q155 VanDerWaalsContact C-N 3.32Å; W153-Q155 PolarHBondContact O-N 2.96Å; Q155-N158 PolarHBondContact O-N 3.31Å; Q155-L159 PolarHBondContact O-N 3.13Å
156	V	81.5	Confident	73.6	Confident	74 Å²	74	110.4 Å²	110.4	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-44.7	176.3	171.7	0	0	0	0	111.1	R152 W153 N158 L159 I160	R152-V156 WeakPolarHBondContact O-CG2 3.35Å; R152-V156 PolarHBondContact O-N 3.45Å; W153-V156 PolarHBondContact O-N 2.84Å; V156-N158 PolarHBondContact O-N 3.46Å; V156-L159 WeakPolarHBondContact O-CB 3.44Å; V156-L159 PolarHBondContact O-N 3.26Å; V156-L159 VanDerWaalsContact O-N 3.14Å; V156-I160 HydrophobicContact CG1-CD1 3.81Å; V156-I160 WeakPolarHBondContact O-CG1 3.46Å; V156-I160 PolarHBondContact O-N 2.83Å
157	L	78.7	Confident	74.4	Confident	65 Å²	65	114 Å²	114	34%	0.34	54%	0.542	S	S	.	.	H	α-helix	trans	-59.4	-45.3	175.9	-78.9	172.8	0	0	0	112.2	W153 L159 I160 N161	W153-L157 VanDerWaalsContact NE1-CD1 3.35Å; W153-L157 PolarHBondContact O-N 2.68Å; L157-L159 VanDerWaalsContact C-N 3.27Å; L157-L159 PolarHBondContact O-N 3.39Å; L157-I160 PolarHBondContact O-N 3.41Å; L157-N161 PolarHBondContact O-N 3.11Å
158	N	79.6	Confident	75	Confident	103 Å²	103	113.5 Å²	113.5	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-64.4	-32.4	176.2	-82.6	-32.4	0	0	0	112.7	N154 Q155 V156 R162	N154-N158 WeakPolarHBondContact O-CB 3.22Å; N154-N158 PolarHBondContact O-N 3.07Å; N154-N158 PolarHBondContact O-ND2 2.93Å; Q155-N158 PolarHBondContact O-N 3.31Å; V156-N158 PolarHBondContact O-N 3.46Å; N158-R162 PolarHBondContact O-N 3.35Å
159	L	78.1	Confident	74.9	Confident	111 Å²	111	111.2 Å²	111.2	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-69.2	-37	174.7	-130.5	79.7	0	0	0	112.2	Q155 V156 L157 K163	Q155-L159 PolarHBondContact O-N 3.13Å; V156-L159 WeakPolarHBondContact O-CB 3.44Å; V156-L159 PolarHBondContact O-N 3.26Å; V156-L159 VanDerWaalsContact O-N 3.14Å; L157-L159 VanDerWaalsContact C-N 3.27Å; L157-L159 PolarHBondContact O-N 3.39Å; L159-K163 PolarHBondContact O-N 3.09Å
160	I	75	Confident	74.6	Confident	75 Å²	75	107.8 Å²	107.8	39%	0.385	51%	0.506	S	S	.	.	H	α-helix	trans	-68	-47.5	176.3	-67.4	162.9	0	0	0	109.7	V156 L157 R162 K163 F164	V156-I160 HydrophobicContact CG1-CD1 3.81Å; V156-I160 WeakPolarHBondContact O-CG1 3.46Å; V156-I160 PolarHBondContact O-N 2.83Å; L157-I160 PolarHBondContact O-N 3.41Å; I160-R162 PolarHBondContact O-N 3.34Å; I160-K163 PolarHBondContact O-N 3.48Å; I160-K163 VanDerWaalsContact O-N 3.14Å; I160-F164 HydrophobicContact CG2-CD2 4.32Å; I160-F164 PolarHBondContact O-N 3.48Å; I160-F164 VanDerWaalsContact O-N 3.15Å
161	N	68.4	Low	74.9	Confident	87 Å²	87	108.9 Å²	108.9	47%	0.465	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-27.4	179.3	-72.1	-12.6	0	0	0	113.5	L157	L157-N161 PolarHBondContact O-N 3.11Å
162	R	71.5	Confident	74.6	Confident	229 Å²	229	109.4 Å²	109.4	86%	0.864	51%	0.51	S	S	*	.	H	α-helix	trans	-79.3	-26.1	176.2	-83.6	-169.3	169.6	-166.9	-2	114.5	N158 I160	N158-R162 PolarHBondContact O-N 3.35Å; I160-R162 PolarHBondContact O-N 3.34Å
163	K	72.1	Confident	74.1	Confident	166 Å²	166	105 Å²	105	72%	0.722	50%	0.499	S	S	*	.	H	α-helix	trans	-97.4	-21.2	-174.2	-77.5	-172.3	176.7	-175.1	0	113.6	L159 I160	L159-K163 PolarHBondContact O-N 3.09Å; I160-K163 PolarHBondContact O-N 3.48Å; I160-K163 VanDerWaalsContact O-N 3.14Å
164	F	68.8	Low	73.7	Confident	95 Å²	95	101.9 Å²	101.9	42%	0.417	49%	0.491	S	S	.	.	S	Bend	trans	-116.3	124	-174.2	-75.1	-82.1	0	0	0	110.6	I160 I168 I169	I160-F164 HydrophobicContact CG2-CD2 4.32Å; I160-F164 PolarHBondContact O-N 3.48Å; I160-F164 VanDerWaalsContact O-N 3.15Å; F164-I168 HydrophobicContact CD1-CB 4.18Å; F164-I168 HydrophobicContact CD1-CD1 3.95Å; F164-I168 HydrophobicContact CD1-CG2 3.74Å; F164-I168 HydrophobicContact CE1-CG2 4.32Å; F164-I169 HydrophobicContact CB-CD1 4.33Å; F164-I169 HydrophobicContact CB-CG1 3.95Å
165	E	75.8	Confident	73.5	Confident	129 Å²	129	100.9 Å²	100.9	60%	0.603	49%	0.49	S	S	*	.			trans	-51.9	141.6	169.6	-66.7	-62.1	150.8	0	0	110.1	Y167 I168 I169	E165-Y167 PolarHBondContact O-N 3.42Å; E165-I168 HydrophobicContact CB-CD1 4.39Å; E165-I168 HydrophobicContact CB-CG1 4.49Å; E165-I168 PolarHBondContact O-N 2.85Å; E165-I169 PolarHBondContact O-N 3.47Å
166	P	67.7	Low	73.1	Confident	69 Å²	69	100.6 Å²	100.6	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-57.5	-27.6	-172.5	22.7	-33.9	0	0	0	113.1	I168 I169 S170	P166-I168 VanDerWaalsContact C-N 3.31Å; P166-I168 PolarHBondContact O-N 3.27Å; P166-I169 PolarHBondContact O-N 2.81Å; P166-S170 PolarHBondContact O-N 3.33Å; P166-S170 PolarHBondContact O-OG 3.38Å
167	Y	73.2	Confident	72.2	Confident	182 Å²	182	98 Å²	98	71%	0.714	48%	0.476	S	S	*	.	H	α-helix	trans	-65.1	-30.9	175.2	-52.1	-73.8	0	0	0	113.3	E165 S170 F171	E165-Y167 PolarHBondContact O-N 3.42Å; Y167-S170 WeakPolarHBondContact CA-OG 3.08Å; Y167-S170 PolarHBondContact O-OG 3.36Å; Y167-F171 WeakPolarHBondContact O-CB 3.42Å; Y167-F171 PolarHBondContact O-N 2.98Å
168	I	76.3	Confident	71.6	Confident	75 Å²	75	100.9 Å²	100.9	39%	0.385	49%	0.491	S	S	.	.	H	α-helix	trans	-77.9	-38.7	177.2	-56.3	172.6	0	0	0	110	F164 E165 P166 F171 L172	F164-I168 HydrophobicContact CD1-CB 4.18Å; F164-I168 HydrophobicContact CD1-CD1 3.95Å; F164-I168 HydrophobicContact CD1-CG2 3.74Å; F164-I168 HydrophobicContact CE1-CG2 4.32Å; E165-I168 HydrophobicContact CB-CD1 4.39Å; E165-I168 HydrophobicContact CB-CG1 4.49Å; E165-I168 PolarHBondContact O-N 2.85Å; P166-I168 VanDerWaalsContact C-N 3.31Å; P166-I168 PolarHBondContact O-N 3.27Å; I168-F171 PolarHBondContact O-N 2.89Å; I168-L172 HydrophobicContact CG2-CD1 4.06Å; I168-L172 HydrophobicContact CG2-CG 4.29Å; I168-L172 WeakPolarHBondContact O-CB 3.5Å; I168-L172 WeakPolarHBondContact O-CG 3.37Å; I168-L172 PolarHBondContact O-N 3.21Å
169	I	70.5	Confident	70.8	Confident	28 Å²	28	107 Å²	107	14%	0.144	51%	0.506	C	S	.	.	H	α-helix	trans	-63.9	-45.3	178.7	-58.2	172.1	0	0	0	110	F164 E165 P166 L172 L173	F164-I169 HydrophobicContact CB-CD1 4.33Å; F164-I169 HydrophobicContact CB-CG1 3.95Å; E165-I169 PolarHBondContact O-N 3.47Å; P166-I169 PolarHBondContact O-N 2.81Å; I169-L172 PolarHBondContact O-N 3.43Å; I169-L173 HydrophobicContact CG2-CD1 3.78Å; I169-L173 HydrophobicContact CG2-CG 4.31Å; I169-L173 VanDerWaalsContact O-CB 3.3Å; I169-L173 WeakPolarHBondContact O-CB 3.3Å; I169-L173 VanDerWaalsContact O-CG 3.25Å; I169-L173 WeakPolarHBondContact O-CG 3.49Å; I169-L173 PolarHBondContact O-N 2.94Å
170	S	68.7	Low	70.2	Confident	43 Å²	43	103.9 Å²	103.9	30%	0.301	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-44.2	174.8	48.7	0	0	0	0	112.2	P166 Y167 L172 L173 E174	P166-S170 PolarHBondContact O-N 3.33Å; P166-S170 PolarHBondContact O-OG 3.38Å; Y167-S170 WeakPolarHBondContact CA-OG 3.08Å; Y167-S170 PolarHBondContact O-OG 3.36Å; S170-L172 PolarHBondContact O-N 3.4Å; S170-L173 PolarHBondContact O-N 3.49Å; S170-E174 VanDerWaalsContact O-CB 3.27Å; S170-E174 WeakPolarHBondContact O-CB 3.39Å; S170-E174 PolarHBondContact O-N 2.91Å
171	F	74.6	Confident	69.7	Low	143 Å²	143	111.6 Å²	111.6	63%	0.627	52%	0.518	S	S	*	.	H	α-helix	trans	-63.7	-41.9	176.6	-168.5	-95.9	0	0	0	113	Y167 I168 E174 S175	Y167-F171 WeakPolarHBondContact O-CB 3.42Å; Y167-F171 PolarHBondContact O-N 2.98Å; I168-F171 PolarHBondContact O-N 2.89Å; F171-E174 PolarHBondContact O-N 3.24Å; F171-S175 WeakPolarHBondContact O-CB 3.42Å; F171-S175 PolarHBondContact O-N 3.37Å
172	L	71.8	Confident	69.5	Low	88 Å²	88	114 Å²	114	46%	0.461	53%	0.53	S	S	.	.	H	α-helix	trans	-66.5	-44	176.4	-74.8	176.6	0	0	0	111.3	I168 I169 S170 E174 S175 L176	I168-L172 HydrophobicContact CG2-CD1 4.06Å; I168-L172 HydrophobicContact CG2-CG 4.29Å; I168-L172 WeakPolarHBondContact O-CB 3.5Å; I168-L172 WeakPolarHBondContact O-CG 3.37Å; I168-L172 PolarHBondContact O-N 3.21Å; I169-L172 PolarHBondContact O-N 3.43Å; S170-L172 PolarHBondContact O-N 3.4Å; L172-E174 VanDerWaalsContact C-N 3.34Å; L172-S175 PolarHBondContact O-N 2.85Å; L172-S175 PolarHBondContact O-OG 3.5Å; L172-L176 WeakPolarHBondContact O-CB 3.25Å; L172-L176 PolarHBondContact O-N 3.39Å
173	L	70.1	Confident	68.9	Low	87 Å²	87	106 Å²	106	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-63.2	-39.6	175.6	-75.3	170.8	0	0	0	111.5	I169 S170 L176 C177 F188	I169-L173 HydrophobicContact CG2-CD1 3.78Å; I169-L173 HydrophobicContact CG2-CG 4.31Å; I169-L173 VanDerWaalsContact O-CB 3.3Å; I169-L173 WeakPolarHBondContact O-CB 3.3Å; I169-L173 VanDerWaalsContact O-CG 3.25Å; I169-L173 WeakPolarHBondContact O-CG 3.49Å; I169-L173 PolarHBondContact O-N 2.94Å; S170-L173 PolarHBondContact O-N 3.49Å; L173-L176 PolarHBondContact O-N 2.95Å; L173-C177 WeakPolarHBondContact O-CB 3.42Å; L173-C177 PolarHBondContact O-N 3.32Å; L173-F188 HydrophobicContact CB-CE2 4.18Å
174	E	69.7	Low	68.6	Low	97 Å²	97	101.4 Å²	101.4	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-46.3	175.1	-162	170.6	-166	0	0	110.8	S170 F171 L172 L176 C177 I178 F188	S170-E174 VanDerWaalsContact O-CB 3.27Å; S170-E174 WeakPolarHBondContact O-CB 3.39Å; S170-E174 PolarHBondContact O-N 2.91Å; F171-E174 PolarHBondContact O-N 3.24Å; L172-E174 VanDerWaalsContact C-N 3.34Å; E174-L176 PolarHBondContact O-N 3.03Å; E174-C177 PolarHBondContact O-N 3.44Å; E174-I178 HydrophobicContact CG-CD1 4.04Å; E174-I178 WeakPolarHBondContact O-CB 3.24Å; E174-I178 WeakPolarHBondContact O-CD1 3.33Å; E174-I178 VanDerWaalsContact O-CG1 3.22Å; E174-I178 WeakPolarHBondContact O-CG1 3.27Å; E174-I178 PolarHBondContact O-N 2.81Å; E174-F188 HydrophobicContact CB-CE1 4.43Å; E174-F188 HydrophobicContact CB-CZ 3.72Å; E174-F188 HydrophobicContact CG-CE1 4.15Å; E174-F188 HydrophobicContact CG-CZ 3.91Å
175	S	72	Confident	68.2	Low	50 Å²	50	107.8 Å²	107.8	35%	0.35	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-40	176.3	80.8	0	0	0	0	112.9	F171 L172 R179	F171-S175 WeakPolarHBondContact O-CB 3.42Å; F171-S175 PolarHBondContact O-N 3.37Å; L172-S175 PolarHBondContact O-N 2.85Å; L172-S175 PolarHBondContact O-OG 3.5Å; S175-R179 WeakPolarHBondContact O-CB 3.3Å; S175-R179 PolarHBondContact O-N 2.8Å; S175-R179 VanDerWaalsContact O-N 3.13Å
176	L	70.6	Confident	67.7	Low	116 Å²	116	105.5 Å²	105.5	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-69.6	-39.5	176.8	-118.5	97.2	0	0	0	111.3	L172 L173 E174 R179 S180	L172-L176 WeakPolarHBondContact O-CB 3.25Å; L172-L176 PolarHBondContact O-N 3.39Å; L173-L176 PolarHBondContact O-N 2.95Å; E174-L176 PolarHBondContact O-N 3.03Å; L176-R179 PolarHBondContact O-N 3.37Å; L176-S180 VanDerWaalsContact O-CB 3.27Å; L176-S180 WeakPolarHBondContact O-CB 3.41Å; L176-S180 PolarHBondContact O-N 2.98Å; L176-S180 PolarHBondContact O-OG 3.47Å
177	C	64.1	Low	67.6	Low	19 Å²	19	106.9 Å²	106.9	13%	0.128	52%	0.515	C	S	.	.	H	α-helix	trans	-66.4	-44.3	179.9	-166.4	0	0	0	0	110.8	L173 E174 R179 S180 R181 F188	L173-C177 WeakPolarHBondContact O-CB 3.42Å; L173-C177 PolarHBondContact O-N 3.32Å; E174-C177 PolarHBondContact O-N 3.44Å; C177-R179 VanDerWaalsContact C-N 3.31Å; C177-R179 PolarHBondContact O-N 2.88Å; C177-S180 PolarHBondContact O-N 3.47Å; C177-R181 PolarHBondContact O-N 3.19Å; C177-R181 VanDerWaalsContact O-N 3.11Å; C177-F188 HydrophobicContact CB-CD2 3.9Å; C177-F188 HydrophobicContact CB-CE2 3.91Å
178	I	65.8	Low	67.2	Low	126 Å²	126	99.8 Å²	99.8	65%	0.646	49%	0.488	S	S	*	.	H	α-helix	trans	-59.7	-42.1	174	-69.3	160.1	0	0	0	110.9	E174	E174-I178 HydrophobicContact CG-CD1 4.04Å; E174-I178 WeakPolarHBondContact O-CB 3.24Å; E174-I178 WeakPolarHBondContact O-CD1 3.33Å; E174-I178 VanDerWaalsContact O-CG1 3.22Å; E174-I178 WeakPolarHBondContact O-CG1 3.27Å; E174-I178 PolarHBondContact O-N 2.81Å
179	R	63.1	Low	66.8	Low	231 Å²	231	100.5 Å²	100.5	87%	0.872	50%	0.496	S	S	*	.	H	α-helix	trans	-77.2	-28.8	-176.8	-160.9	163.5	-174.2	175	0.6	113.8	S175 L176 C177	S175-R179 WeakPolarHBondContact O-CB 3.3Å; S175-R179 PolarHBondContact O-N 2.8Å; S175-R179 VanDerWaalsContact O-N 3.13Å; L176-R179 PolarHBondContact O-N 3.37Å; C177-R179 VanDerWaalsContact C-N 3.31Å; C177-R179 PolarHBondContact O-N 2.88Å
180	S	64.2	Low	66.8	Low	47 Å²	47	106.2 Å²	106.2	33%	0.329	52%	0.52	S	S	.	.	H	α-helix	trans	-95.9	-12.9	-175.7	60.8	0	0	0	0	114.5	L176 C177 I182	L176-S180 VanDerWaalsContact O-CB 3.27Å; L176-S180 WeakPolarHBondContact O-CB 3.41Å; L176-S180 PolarHBondContact O-N 2.98Å; L176-S180 PolarHBondContact O-OG 3.47Å; C177-S180 PolarHBondContact O-N 3.47Å; S180-I182 WeakPolarHBondContact O-CB 3.42Å; S180-I182 VanDerWaalsContact O-CG1 3.3Å; S180-I182 WeakPolarHBondContact O-CG1 3.34Å; S180-I182 PolarHBondContact O-N 3.37Å
181	R	64.5	Low	66.7	Low	237 Å²	237	108.7 Å²	108.7	89%	0.894	53%	0.529	S	S	*	.			trans	44.8	23.3	-175.5	-72.1	-171.7	179.8	-179.9	0.8	113.5	C177	C177-R181 PolarHBondContact O-N 3.19Å; C177-R181 VanDerWaalsContact O-N 3.11Å
182	I	63.9	Low	66.3	Low	138 Å²	138	105.7 Å²	105.7	71%	0.708	52%	0.519	S	S	*	.			trans	-98.1	-21	-165.2	-97.6	157.6	0	0	0	112.6	S180	S180-I182 WeakPolarHBondContact O-CB 3.42Å; S180-I182 VanDerWaalsContact O-CG1 3.3Å; S180-I182 WeakPolarHBondContact O-CG1 3.34Å; S180-I182 PolarHBondContact O-N 3.37Å
183	L	60.2	Low	66.2	Low	60 Å²	60	106.2 Å²	106.2	31%	0.314	53%	0.529	S	S	.	.	S	Bend	trans	-110.7	126.6	173	-69.8	93.7	0	0	0	109.8	L187 L191	L183-L187 HydrophobicContact CB-CB 4.43Å; L183-L187 HydrophobicContact CD2-CB 4.17Å; L183-L191 HydrophobicContact CD2-CD1 3.62Å
184	S	65.7	Low	66.1	Low	69 Å²	69	111.1 Å²	111.1	48%	0.483	55%	0.548	S	S	.	.			trans	-56	143.3	167.1	62.4	0	0	0	0	108.6	S186 L187 F188	S184-S186 PolarHBondContact O-N 2.98Å; S184-L187 PolarHBondContact O-N 3.01Å; S184-F188 PolarHBondContact O-N 2.98Å
185	R	59.1	Low	65.8	Low	230 Å²	230	113.4 Å²	113.4	87%	0.868	57%	0.568	S	S	*	*	H	α-helix	trans	-46.9	-33.4	176.9	-88.9	175.6	144.3	146.1	-6.3	112.5	F188 V189	R185-F188 PolarHBondContact O-N 3.14Å; R185-V189 WeakPolarHBondContact O-CG2 3.36Å; R185-V189 PolarHBondContact O-N 3.04Å; R185-V189 VanDerWaalsContact O-N 3.15Å
186	S	66.3	Low	65.5	Low	80 Å²	80	116.6 Å²	116.6	56%	0.559	58%	0.579	S	S	*	*	H	α-helix	trans	-63.8	-42.8	176.9	-165.8	0	0	0	0	113.7	S184 F190	S184-S186 PolarHBondContact O-N 2.98Å; S186-F190 PolarHBondContact O-N 2.97Å
187	L	64.1	Low	65.2	Low	99 Å²	99	116.6 Å²	116.6	52%	0.518	58%	0.577	S	S	.	*	H	α-helix	trans	-71.8	-32.4	178.4	-87.8	165.1	0	0	0	112	L183 S184 F190 L191	L183-L187 HydrophobicContact CB-CB 4.43Å; L183-L187 HydrophobicContact CD2-CB 4.17Å; S184-L187 PolarHBondContact O-N 3.01Å; L187-F190 PolarHBondContact O-N 3.43Å; L187-L191 PolarHBondContact O-N 3.36Å
188	F	65.5	Low	65.2	Low	32 Å²	32	122 Å²	122	14%	0.14	60%	0.602	C	S	.	*	H	α-helix	trans	-66.1	-44.9	176.9	-173.8	-106.8	0	0	0	112	L173 E174 C177 S184 R185 F190 L191 I192	L173-F188 HydrophobicContact CB-CE2 4.18Å; E174-F188 HydrophobicContact CB-CE1 4.43Å; E174-F188 HydrophobicContact CB-CZ 3.72Å; E174-F188 HydrophobicContact CG-CE1 4.15Å; E174-F188 HydrophobicContact CG-CZ 3.91Å; C177-F188 HydrophobicContact CB-CD2 3.9Å; C177-F188 HydrophobicContact CB-CE2 3.91Å; S184-F188 PolarHBondContact O-N 2.98Å; R185-F188 PolarHBondContact O-N 3.14Å; F188-F190 VanDerWaalsContact C-N 3.3Å; F188-F190 PolarHBondContact O-N 3.34Å; F188-L191 PolarHBondContact O-N 3.21Å; F188-I192 HydrophobicContact CD1-CD1 3.73Å; F188-I192 HydrophobicContact CE1-CD1 3.26Å; F188-I192 HydrophobicContact CE1-CG1 4.37Å; F188-I192 HydrophobicContact CE2-CD1 4.34Å; F188-I192 HydrophobicContact CG-CD1 4.44Å; F188-I192 HydrophobicContact CZ-CD1 3.6Å; F188-I192 HydrophobicContact CZ-CG1 4.38Å; F188-I192 WeakPolarHBondContact O-CG1 3.45Å; F188-I192 PolarHBondContact O-N 2.91Å; F188-I192 VanDerWaalsContact O-N 3.09Å
189	V	68.5	Low	65.2	Low	91 Å²	91	121.8 Å²	121.8	55%	0.552	60%	0.599	S	S	*	*	H	α-helix	trans	-61.4	-41.2	174	176.1	0	0	0	0	110.8	R185 L191 I192 S193	R185-V189 WeakPolarHBondContact O-CG2 3.36Å; R185-V189 PolarHBondContact O-N 3.04Å; R185-V189 VanDerWaalsContact O-N 3.15Å; V189-L191 PolarHBondContact O-N 2.84Å; V189-I192 PolarHBondContact O-N 3.15Å; V189-S193 PolarHBondContact O-N 3.24Å; V189-S193 VanDerWaalsContact O-N 3.11Å; V189-S193 PolarHBondContact O-OG 3.02Å
190	F	70.8	Confident	65.3	Low	148 Å²	148	114.9 Å²	114.9	65%	0.649	58%	0.582	S	S	*	*	H	α-helix	trans	-61.9	-40.6	176.1	-105.8	-86.8	0	0	0	113.4	S186 L187 F188 S193	S186-F190 PolarHBondContact O-N 2.97Å; L187-F190 PolarHBondContact O-N 3.43Å; F188-F190 VanDerWaalsContact C-N 3.3Å; F188-F190 PolarHBondContact O-N 3.34Å; F190-S193 PolarHBondContact O-N 3.18Å
191	L	65.8	Low	65.4	Low	95 Å²	95	119.5 Å²	119.5	50%	0.497	60%	0.599	S	S	.	*	H	α-helix	trans	-67.9	-37.4	177.5	-91.1	163	0	0	0	112.3	L183 L187 F188 V189 F194 V195	L183-L191 HydrophobicContact CD2-CD1 3.62Å; L187-L191 PolarHBondContact O-N 3.36Å; F188-L191 PolarHBondContact O-N 3.21Å; V189-L191 PolarHBondContact O-N 2.84Å; L191-F194 PolarHBondContact O-N 3.47Å; L191-V195 WeakPolarHBondContact O-CG2 3.38Å; L191-V195 PolarHBondContact O-N 3.45Å
192	I	66.3	Low	65.5	Low	80 Å²	80	111.1 Å²	111.1	41%	0.41	58%	0.578	S	S	.	*	H	α-helix	trans	-67.4	-37.6	176.6	-68.2	167.9	0	0	0	111.4	F188 V189 F194	F188-I192 HydrophobicContact CD1-CD1 3.73Å; F188-I192 HydrophobicContact CE1-CD1 3.26Å; F188-I192 HydrophobicContact CE1-CG1 4.37Å; F188-I192 HydrophobicContact CE2-CD1 4.34Å; F188-I192 HydrophobicContact CG-CD1 4.44Å; F188-I192 HydrophobicContact CZ-CD1 3.6Å; F188-I192 HydrophobicContact CZ-CG1 4.38Å; F188-I192 WeakPolarHBondContact O-CG1 3.45Å; F188-I192 PolarHBondContact O-N 2.91Å; F188-I192 VanDerWaalsContact O-N 3.09Å; V189-I192 PolarHBondContact O-N 3.15Å; I192-F194 PolarHBondContact O-N 3.14Å
193	S	70.4	Confident	65.6	Low	98 Å²	98	109 Å²	109	69%	0.685	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-12.9	177.8	-69.9	0	0	0	0	114.4	V189 F190	V189-S193 PolarHBondContact O-N 3.24Å; V189-S193 VanDerWaalsContact O-N 3.11Å; V189-S193 PolarHBondContact O-OG 3.02Å; F190-S193 PolarHBondContact O-N 3.18Å
194	F	67.6	Low	66	Low	191 Å²	191	113.1 Å²	113.1	84%	0.838	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-10.3	-176.4	-131	-91.8	0	0	0	114	L191 I192	L191-F194 PolarHBondContact O-N 3.47Å; I192-F194 PolarHBondContact O-N 3.14Å
195	V	62.6	Low	66.1	Low	144 Å²	144	117.1 Å²	117.1	87%	0.873	60%	0.599	S	S	*	*			trans	-90.1	0	171.1	173.9	0	0	0	0	108.7	L191	L191-V195 WeakPolarHBondContact O-CG2 3.38Å; L191-V195 PolarHBondContact O-N 3.45Å

Retrieved 195 of 195 residues in 85.1 ms (Link to these results)

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