A0A078BPM2_CAEEL Loading...

Cysteine/serine-rich nuclear protein N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BPM2, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 919 aa.

						>A0A078BPM2_CAEEL|A0A078BPM2
MQSSASNDPNKPTNNEIIKTPLVPPSPRGGLKRMAGMSQLKSTFSISLERTIPPPSSSSSFLSHSTSMVSVAASLKRAGVPSLTRTKTSALPIKMEKKPMVPLRIEQDHQTPIRKLAPESIPSLEDQVTPPMRRSSSGSMLLRQTPERIRRQEEDVETPGSPVKRYRRSGSMPRLEAQSLDVPIRMEIGNSLTPVLKRKRTSSLTCLFSSDMPPILTPQRLRPRGISETRTIDDDVFVPKSPTKKPITSPIKKRVRQDSENRSTSPLKKRYISSFSIRLEEEKEIEKAVPTPTMSTPMRKFKSTIFNPRAVTERIAQTYGTGSRQLLKSTSSTVLPAPPALVARSTSGETYYSATEGEDSILSAPPPQSTEVISIPKQDDLQRDDGKMVPLVKKQMSIDEKIMEDDEDEGFGDSMKTIKRGQGSSLARSLSLKLSPKTDQQKPIGADTEKSCSTPSLPTAPLLSRQGSTSSLRFKVSPSTFLKPIATPIIDVSPTPRPDPEPLRIIVAAAAAAPVESTELSEPSTSKTPEQKAEPAMQKSALRKHAANFSVREEIFIPGIRRKKIRFSGLHVHYFDRRQGGSTVPTEGDISLDMHNKHHSHRYFSLSTGKRPILDLLLYADDDLSDGEVIDPDSDEDRDYDEYASAKSIPRINQRHRIKLLKKSGVKVEKNTDAIDSLRNTRVECGCSCENGVCLPETCQCAIDGIHCQVDGGEWPTQPCACFAETCTNPEGRTFYDPEAVHEFRQRTIMNWRASQKTGISGSPVVKKFADSDEEDDKAKTWLLKNAIPIKLEESPTKYPVTPVYTRRSRSSLSDIRESTSETTGSITPSTSLSERIKAMQHLDNEVCVEQEEKDEDDAYFMDNKEDTIIEADLTLQEVYVEQDMVAVTVESSSETTDIDANEMIEATAMSPVKTTLVV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	35.3	Very low	35.7	Very low	210 Å²	210	127.2 Å²	127.2	100%	1.034	73%	0.728	S	S	*	*				0	146.9	0	-69.9	165.3	60.6	0	0	107.7
2	Q	32.1	Very low	36.6	Very low	171 Å²	171	125.4 Å²	125.4	80%	0.799	72%	0.724	S	S	*	*			trans	61	169.5	157.9	-72.1	159.7	-25.4	0	0	115.1
3	S	44.3	Very low	36.6	Very low	96 Å²	96	125.1 Å²	125.1	67%	0.671	73%	0.726	S	S	*	*			cis	-155.4	116.9	-11.6	23.6	0	0	0	0	106.5
4	S	29.7	Very low	36.1	Very low	117 Å²	117	125.6 Å²	125.6	82%	0.818	73%	0.725	S	S	*	*				54.8	127.9	100.1	66.8	0	0	0	0	115.1
5	A	43.4	Very low	35.7	Very low	86 Å²	86	125.6 Å²	125.6	71%	0.711	72%	0.721	S	S	*	*			cis	-141	171.4	11.3	0	0	0	0	0	109.5
6	S	35.9	Very low	35.6	Very low	102 Å²	102	126.6 Å²	126.6	71%	0.713	72%	0.717	S	S	*	*			cis	69.6	149.6	23.5	88	0	0	0	0	114.9
7	N	32.9	Very low	35.3	Very low	139 Å²	139	128.2 Å²	128.2	74%	0.743	72%	0.721	S	S	*	*			cis	-112.8	-171.9	8.8	-54.8	-18.5	0	0	0	109.6
8	D	32.5	Very low	34.9	Very low	110 Å²	110	127.7 Å²	127.7	59%	0.588	72%	0.716	S	S	*	*			cis	70.5	142.4	17.7	-164.9	79	0	0	0	116.4	K11	D8-K11 WeakPolarHBondContact OD1-CE 3.47Å; D8-K11 IonicContact OD1-NZ 2.72Å; D8-K11 PolarHBondContact OD1-NZ 2.73Å; D8-K11 IonicContact OD2-NZ 2.94Å; D8-K11 PolarHBondContact OD2-NZ 3.38Å
9	P	49.3	Very low	34.5	Very low	88 Å²	88	131.6 Å²	131.6	57%	0.571	72%	0.724	S	S	*	*			cis	-93.7	-160	-7.6	44.3	-38.1	0	0	0	111.4	K11	P9-K11 HydrophobicContact CB-CD 4.2Å
10	N	29	Very low	34.2	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	73%	0.727	S	S	*	*			cis	-141.5	159	10.3	-99.1	-41.5	0	0	0	108.6
11	K	28.7	Very low	34.6	Very low	142 Å²	142	130.1 Å²	130.1	62%	0.617	72%	0.724	S	S	*	*			cis	82	152.5	19	-55	163.1	-178.3	159	0	114.3	D8 P9	D8-K11 WeakPolarHBondContact OD1-CE 3.47Å; D8-K11 IonicContact OD1-NZ 2.72Å; D8-K11 PolarHBondContact OD1-NZ 2.73Å; D8-K11 IonicContact OD2-NZ 2.94Å; D8-K11 PolarHBondContact OD2-NZ 3.38Å; P9-K11 HydrophobicContact CB-CD 4.2Å
12	P	46.5	Very low	34.5	Very low	106 Å²	106	128.1 Å²	128.1	69%	0.688	72%	0.717	S	S	*	*			cis	-121.6	151.4	7.5	40	-26	0	0	0	117.5
13	T	36.6	Very low	34.8	Very low	121 Å²	121	126 Å²	126	74%	0.742	72%	0.716	S	S	*	*			trans	65	131.7	146.5	52.1	0	0	0	0	119
14	N	29.2	Very low	35.4	Very low	133 Å²	133	126.9 Å²	126.9	71%	0.711	72%	0.719	S	S	*	*			cis	-147.4	173.5	8.4	-86.4	-25.6	0	0	0	109
15	N	30.5	Very low	36	Very low	125 Å²	125	127.2 Å²	127.2	67%	0.668	72%	0.718	S	S	*	*			cis	75.3	131.6	31.6	-61.8	79.9	0	0	0	114.2
16	E	33.1	Very low	35.4	Very low	142 Å²	142	128.2 Å²	128.2	66%	0.664	72%	0.72	S	S	*	*			cis	-152.9	-150.6	-7	-136.7	177.8	-87.6	0	0	110.2
17	I	31.1	Very low	37	Very low	153 Å²	153	128.7 Å²	128.7	79%	0.785	72%	0.721	S	S	*	*			cis	-148.9	-139.7	22.5	-160.6	158.1	0	0	0	112.3
18	I	28	Very low	37.1	Very low	120 Å²	120	134.2 Å²	134.2	62%	0.615	73%	0.731	S	S	*	*			trans	-135	134.1	-155.4	-47	158.8	0	0	0	113.2
19	K	28.1	Very low	37.1	Very low	201 Å²	201	132.9 Å²	132.9	87%	0.874	74%	0.744	S	S	*	*				-179.5	147.1	119.2	-94.6	168.4	-172.5	172.7	0	115.8
20	T	27.8	Very low	36.4	Very low	128 Å²	128	132.3 Å²	132.3	79%	0.785	75%	0.754	S	S	*	*			trans	-103.4	-171.5	-171.1	52	0	0	0	0	111.1
21	P	43.3	Very low	36.5	Very low	104 Å²	104	134.3 Å²	134.3	68%	0.675	76%	0.764	S	S	*	*			cis	-149.2	177.9	11.8	45.9	-25.5	0	0	0	120
22	L	31.7	Very low	37	Very low	168 Å²	168	136.1 Å²	136.1	88%	0.88	77%	0.772	S	S	*	*			trans	52.2	166.8	145.5	-91.5	78.9	0	0	0	123.7
23	V	38.8	Very low	36.5	Very low	127 Å²	127	142.8 Å²	142.8	77%	0.77	78%	0.783	S	S	*	*			trans	-125.7	152.5	-173.4	168.8	0	0	0	0	107.8
24	P	57.4	Low	36.4	Very low	115 Å²	115	145.4 Å²	145.4	75%	0.747	79%	0.789	S	S	*	*			cis	-115.4	-140.3	9.3	35.4	-12.4	0	0	0	110.3
25	P	41.8	Very low	36.5	Very low	123 Å²	123	143.6 Å²	143.6	80%	0.799	79%	0.793	S	S	*	*			cis	-137.1	-161	-1	45.4	-24.2	0	0	0	116.7
26	S	32.2	Very low	36.4	Very low	108 Å²	108	140.8 Å²	140.8	76%	0.755	79%	0.793	S	S	*	*			trans	-107.7	-173.1	175.8	62	0	0	0	0	112.6
27	P	68	Low	36.3	Very low	111 Å²	111	143.2 Å²	143.2	72%	0.721	81%	0.807	S	S	*	*				-127.7	166.5	-82	40	-25.6	0	0	0	114.7
28	R	36	Very low	36.3	Very low	255 Å²	255	140.5 Å²	140.5	96%	0.962	80%	0.801	S	S	*	*			trans	164.5	153.8	143.6	-97.4	166.4	180	-153.3	0	116
29	G	31.7	Very low	36.5	Very low	82 Å²	82	143.2 Å²	143.2	85%	0.845	81%	0.811	S	S	*	*			trans	120	136.2	150.2	0	0	0	0	0	115.8
30	G	34.4	Very low	36.6	Very low	77 Å²	77	141.3 Å²	141.3	79%	0.794	81%	0.81	S	S	*	*			cis	137.6	148.7	-11.2	0	0	0	0	0	114.3
31	L	31.5	Very low	36.8	Very low	180 Å²	180	144.9 Å²	144.9	94%	0.942	81%	0.814	S	S	*	*			trans	-155.7	166.1	165.5	-110.9	169.7	0	0	0	112.1
32	K	39.9	Very low	36.1	Very low	180 Å²	180	145.4 Å²	145.4	78%	0.783	82%	0.821	S	S	*	*			trans	-116.3	160.2	-167.1	-58.2	-178.7	178.8	177.6	0	112.3
33	R	35.3	Very low	36.1	Very low	246 Å²	246	142.8 Å²	142.8	93%	0.928	81%	0.812	S	S	*	*				-130.1	-131.8	83.2	-60.7	-165.8	178.2	-157.8	-0.4	114.7
34	M	34.4	Very low	35.5	Very low	175 Å²	175	145.8 Å²	145.8	86%	0.862	82%	0.815	S	S	*	*			trans	-172.7	166.6	-157.9	-91.4	156	59.8	0	0	106.8
35	A	32	Very low	34.1	Very low	96 Å²	96	144.7 Å²	144.7	79%	0.793	81%	0.81	S	S	*	*			cis	-171.8	177.2	-13.7	0	0	0	0	0	106.2
36	G	27.8	Very low	33.4	Very low	65 Å²	65	147 Å²	147	67%	0.67	81%	0.814	S	S	*	*			cis	166.2	-163	3.3	0	0	0	0	0	110.9
37	M	31.7	Very low	33.2	Very low	194 Å²	194	146.7 Å²	146.7	96%	0.956	81%	0.812	S	S	*	*			trans	69.4	150.3	178.1	-53.4	176.1	67.3	0	0	114.2
38	S	31	Very low	31.3	Very low	95 Å²	95	148.6 Å²	148.6	66%	0.664	82%	0.815	S	S	*	*			cis	-150.9	123.3	0.7	56.3	0	0	0	0	109.5
39	Q	32.2	Very low	30.9	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	80%	0.799	S	S	*	*				85.8	153.7	97.3	-79.1	-77.6	19.6	0	0	118.6
40	L	30.7	Very low	30.8	Very low	161 Å²	161	148.9 Å²	148.9	84%	0.843	80%	0.796	S	S	*	*			trans	83.9	160.7	165.7	-64.8	-178.4	0	0	0	121.2
41	K	30.5	Very low	30.3	Very low	203 Å²	203	150.8 Å²	150.8	88%	0.883	79%	0.793	S	S	*	*			trans	-116.8	156.6	-164.7	-47.2	165.3	-177	173.1	0	110.1
42	S	29.1	Very low	30.5	Very low	116 Å²	116	149.6 Å²	149.6	81%	0.811	79%	0.786	S	S	*	*			trans	-154.3	167.2	144.9	-160.7	0	0	0	0	111.5
43	T	31.6	Very low	30.7	Very low	113 Å²	113	146.6 Å²	146.6	69%	0.693	79%	0.785	S	S	*	*			trans	-131.2	174.1	-176.6	42.2	0	0	0	0	110.8
44	F	27	Very low	31.5	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	77%	0.771	S	S	*	*			trans	81.4	112.3	171.1	-68.6	-83	0	0	0	119
45	S	28.3	Very low	31.7	Very low	93 Å²	93	137 Å²	137	65%	0.65	77%	0.768	S	S	*	*			trans	1.9	145.7	133.3	58.1	0	0	0	0	120.6
46	I	26.4	Very low	31.5	Very low	170 Å²	170	137.3 Å²	137.3	87%	0.872	76%	0.764	S	S	*	*				-161.4	167	110.5	-102.4	158.9	0	0	0	110.7
47	S	27.8	Very low	31.5	Very low	102 Å²	102	139.6 Å²	139.6	71%	0.713	77%	0.77	S	S	*	*			trans	-87.2	168.2	-172.4	-48.1	0	0	0	0	115
48	L	29.2	Very low	31.4	Very low	152 Å²	152	135.1 Å²	135.1	80%	0.796	76%	0.757	S	S	*	*			trans	83.8	139.7	146.5	-133.7	76.2	0	0	0	120.5
49	E	27.1	Very low	31.3	Very low	134 Å²	134	136.1 Å²	136.1	63%	0.626	76%	0.764	S	S	*	*			trans	44.4	114.8	150.7	-85.7	-168.9	118	0	0	124.7
50	R	28.3	Very low	31.2	Very low	208 Å²	208	131.5 Å²	131.5	79%	0.785	75%	0.752	S	S	*	*				74.5	156.4	124.4	-92.9	177.6	166.2	144.8	-11.2	123.2
51	T	24.6	Very low	31.1	Very low	118 Å²	118	132.7 Å²	132.7	72%	0.724	75%	0.75	S	S	*	*			trans	78.5	107.9	151	35.3	0	0	0	0	122.8
52	I	35	Very low	31	Very low	154 Å²	154	130 Å²	130	79%	0.79	75%	0.745	S	S	*	*				-8.4	164	119.6	33.4	170	0	0	0	117.6
53	P	45	Very low	30.8	Very low	117 Å²	117	128 Å²	128	76%	0.76	73%	0.731	S	S	*	*			cis	-145.4	-116.9	34.6	29.6	0.2	0	0	0	118.4
54	P	52.3	Low	30.7	Very low	100 Å²	100	131 Å²	131	65%	0.649	74%	0.736	S	S	*	*				-122.4	-159.9	-105	42	-21.3	0	0	0	114.8
55	P	38.2	Very low	30.9	Very low	121 Å²	121	126.3 Å²	126.3	79%	0.786	73%	0.727	S	S	*	*				-131.4	163.2	71.2	38.1	-24.7	0	0	0	114
56	S	28.3	Very low	31.1	Very low	102 Å²	102	127.5 Å²	127.5	71%	0.713	73%	0.731	S	S	*	*			cis	103.2	88.3	4.9	84.8	0	0	0	0	118.8
57	S	28.1	Very low	31.5	Very low	113 Å²	113	124.1 Å²	124.1	79%	0.79	72%	0.722	S	S	*	*			trans	-165	142.9	155.3	54.4	0	0	0	0	109.6
58	S	29.1	Very low	31.8	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	73%	0.725	S	S	*	*			cis	152.4	142.2	-22.9	49.8	0	0	0	0	106.9
59	S	28.5	Very low	31.9	Very low	115 Å²	115	125.6 Å²	125.6	80%	0.804	72%	0.724	S	S	*	*			trans	71.6	157.2	171.7	87.1	0	0	0	0	116.6
60	S	29.3	Very low	32.2	Very low	81 Å²	81	123.6 Å²	123.6	57%	0.566	73%	0.725	S	S	*	*			cis	-175.5	160.5	-29	54	0	0	0	0	113.8
61	F	28.6	Very low	32.3	Very low	186 Å²	186	119.8 Å²	119.8	82%	0.816	72%	0.724	S	S	*	*			trans	77.9	140.8	145	-69.9	-48.8	0	0	0	122.9
62	L	29.3	Very low	32.5	Very low	147 Å²	147	118.6 Å²	118.6	77%	0.77	73%	0.727	S	S	*	*			trans	55	122.5	151.3	-58.8	164.7	0	0	0	118
63	S	24.8	Very low	32.2	Very low	73 Å²	73	116.1 Å²	116.1	51%	0.51	73%	0.729	S	S	.	*			cis	72.4	130.8	30.1	95.6	0	0	0	0	116.1
64	H	30	Very low	31.5	Very low	175 Å²	175	115.7 Å²	115.7	81%	0.81	73%	0.729	S	S	*	*			trans	75.8	148.7	166.7	-54.6	127.8	0	0	0	117.3
65	S	30.2	Very low	30.5	Very low	91 Å²	91	117.8 Å²	117.8	64%	0.636	73%	0.734	S	S	*	*			cis	-172.5	179.7	-19.9	55.7	0	0	0	0	112.1
66	T	32.9	Very low	30.1	Very low	119 Å²	119	120.5 Å²	120.5	73%	0.73	73%	0.733	S	S	*	*			trans	89.5	129.3	166.8	70.2	0	0	0	0	116.3
67	S	35.5	Very low	30.2	Very low	98 Å²	98	127.1 Å²	127.1	69%	0.685	74%	0.742	S	S	*	*			cis	88.5	151.9	25.5	95.1	0	0	0	0	114.2
68	M	34.2	Very low	30.3	Very low	158 Å²	158	126.6 Å²	126.6	78%	0.778	75%	0.745	S	S	*	*			cis	-159.4	-153.9	18.2	-132.3	-100.8	-171.4	0	0	111.7
69	V	30.9	Very low	30.1	Very low	127 Å²	127	125.6 Å²	125.6	77%	0.77	75%	0.751	S	S	*	*			trans	86.9	102.2	166.1	-169	0	0	0	0	114.5
70	S	33.1	Very low	30.2	Very low	92 Å²	92	126.9 Å²	126.9	64%	0.643	75%	0.753	S	S	*	*				89.5	149.4	52.6	-68	0	0	0	0	113.3
71	V	30.3	Very low	31.1	Very low	129 Å²	129	128.2 Å²	128.2	78%	0.782	76%	0.76	S	S	*	*			cis	-165.4	168.5	0.6	116.8	0	0	0	0	110.9
72	A	29.4	Very low	31.1	Very low	93 Å²	93	123.9 Å²	123.9	77%	0.769	75%	0.753	S	S	*	*			trans	68.5	161.4	159.8	0	0	0	0	0	119.5
73	A	29	Very low	31	Very low	101 Å²	101	124.2 Å²	124.2	84%	0.835	75%	0.754	S	S	*	*			cis	-161.8	175.1	-23.3	0	0	0	0	0	111.7
74	S	29.5	Very low	31.3	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	76%	0.764	S	S	*	*			trans	-77.7	153.2	-170	-40.2	0	0	0	0	117
75	L	31.3	Very low	31.3	Very low	143 Å²	143	128 Å²	128	75%	0.749	76%	0.764	S	S	*	*				174.6	152.7	118.9	-115.4	62.2	0	0	0	117
76	K	30.3	Very low	31.3	Very low	178 Å²	178	128.1 Å²	128.1	77%	0.774	76%	0.76	S	S	*	*			trans	53.1	105.5	147.7	-71.4	171.6	-172.2	170.2	0	124
77	R	29.6	Very low	31.1	Very low	241 Å²	241	130.8 Å²	130.8	91%	0.909	76%	0.762	S	S	*	*				57.9	121	105.1	-148.9	-175.2	-158.2	-175.5	7.8	122.5
78	A	29.8	Very low	30.9	Very low	103 Å²	103	131.6 Å²	131.6	85%	0.851	76%	0.763	S	S	*	*			trans	74.7	146.3	147	0	0	0	0	0	121.6
79	G	26.4	Very low	30.7	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	77%	0.765	S	S	*	*			trans	139.9	115.3	162.2	0	0	0	0	0	116.6
80	V	30.8	Very low	30.6	Very low	142 Å²	142	127.2 Å²	127.2	86%	0.861	76%	0.758	S	S	*	*			trans	-119.4	163.6	157.1	-118.4	0	0	0	0	106.3
81	P	47.1	Very low	30.5	Very low	109 Å²	109	130.7 Å²	130.7	71%	0.708	77%	0.769	S	S	*	*			cis	-140.6	-167.6	3.5	39.9	-19	0	0	0	116
82	S	28.1	Very low	31.4	Very low	95 Å²	95	129.4 Å²	129.4	66%	0.664	76%	0.763	S	S	*	*			trans	87	122.8	138.5	-75.1	0	0	0	0	123.7
83	L	28.3	Very low	31.5	Very low	153 Å²	153	132.3 Å²	132.3	80%	0.801	76%	0.764	S	S	*	*				83.8	149	128	-75.4	169.1	0	0	0	123.6
84	T	30.4	Very low	31.5	Very low	116 Å²	116	136.3 Å²	136.3	71%	0.712	76%	0.762	S	S	*	*			trans	72.9	101.4	152.9	41.7	0	0	0	0	122.6
85	R	30.2	Very low	31.6	Very low	213 Å²	213	140 Å²	140	80%	0.804	77%	0.77	S	S	*	*				72.1	143.7	102.6	-149.4	-170.8	71.8	179.2	-1.9	120.3
86	T	29.5	Very low	31.6	Very low	92 Å²	92	140.3 Å²	140.3	56%	0.564	77%	0.768	S	S	*	*			trans	85.9	122.7	148	17.5	0	0	0	0	121.1
87	K	30.6	Very low	31.6	Very low	175 Å²	175	140.4 Å²	140.4	76%	0.761	77%	0.768	S	S	*	*				93.4	99.5	128.1	-87.6	177.9	179.4	-168.2	0	123.2
88	T	29.7	Very low	31.9	Very low	116 Å²	116	138.5 Å²	138.5	71%	0.712	77%	0.766	S	S	*	*				61.2	145.9	115.6	57.7	0	0	0	0	123.6
89	S	30.6	Very low	32.8	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	76%	0.76	S	S	*	*			trans	82.2	152.9	147.6	75.8	0	0	0	0	119.3
90	A	29.5	Very low	33	Very low	77 Å²	77	142.7 Å²	142.7	64%	0.636	76%	0.758	S	S	*	*			cis	-172	130.8	-32.8	0	0	0	0	0	112.1
91	L	30.7	Very low	33.2	Very low	165 Å²	165	141.8 Å²	141.8	86%	0.864	75%	0.753	S	S	*	*			trans	59.3	-171.9	141.9	-67.1	174.9	0	0	0	116.7
92	P	49.5	Very low	33.6	Very low	101 Å²	101	141.6 Å²	141.6	66%	0.656	75%	0.751	S	S	*	*			cis	-128.9	-167.7	-42.8	22.6	0.2	0	0	0	113.6
93	I	31.2	Very low	33.7	Very low	154 Å²	154	145.2 Å²	145.2	79%	0.79	76%	0.762	S	S	*	*			trans	101.9	127.4	147.4	-44.2	-169.6	0	0	0	118.6
94	K	28.9	Very low	33.9	Very low	186 Å²	186	147.6 Å²	147.6	81%	0.809	76%	0.761	S	S	*	*			trans	-66.2	171.7	174.6	-44.3	167.9	-179.8	-179.3	0	113.4
95	M	30.9	Very low	33.9	Very low	185 Å²	185	149.8 Å²	149.8	91%	0.911	77%	0.766	S	S	*	*				-155.7	179.8	127.9	-104.2	-58.3	165.5	0	0	110.2
96	E	30.9	Very low	33.9	Very low	151 Å²	151	145.2 Å²	145.2	71%	0.706	75%	0.754	S	S	*	*			trans	-150.7	161.7	-151.6	-169.4	-169.7	-107.1	0	0	112.6
97	K	30.2	Very low	34.1	Very low	180 Å²	180	149.2 Å²	149.2	78%	0.783	77%	0.767	S	S	*	*			trans	111.1	146.1	154.4	-58.4	173	-173.1	177	0	120.2
98	K	37.4	Very low	34	Very low	201 Å²	201	146 Å²	146	87%	0.874	76%	0.758	S	S	*	*			trans	-91	-173.4	164.2	-65.9	-176.6	175.6	-178.4	0	108.9
99	P	48.2	Very low	34.1	Very low	110 Å²	110	147.4 Å²	147.4	71%	0.714	76%	0.756	S	S	*	*			cis	-152.7	178	16.6	46	-24.3	0	0	0	120.8
100	M	30.6	Very low	34	Very low	160 Å²	160	149.8 Å²	149.8	79%	0.788	75%	0.754	S	S	*	*			trans	55.3	126.3	138.9	-80.4	171.9	59.7	0	0	125.9
101	V	35.8	Very low	33.9	Very low	122 Å²	122	152.3 Å²	152.3	74%	0.739	76%	0.762	S	S	*	*				72	158.4	128.4	167.5	0	0	0	0	117.2
102	P	55.4	Low	34.9	Very low	105 Å²	105	149.4 Å²	149.4	68%	0.682	75%	0.753	S	S	*	*			cis	-132.7	179.9	9.3	36.2	-15.5	0	0	0	118.2
103	L	29.2	Very low	33.9	Very low	171 Å²	171	152.1 Å²	152.1	90%	0.895	76%	0.76	S	S	*	*				177.5	169	117.7	-94.3	168.6	0	0	0	113.3
104	R	32.6	Very low	33.8	Very low	203 Å²	203	155 Å²	155	77%	0.766	76%	0.761	S	S	*	*			trans	-163.7	154.3	-167.2	176.9	174.9	176.1	166.5	3.9	114	E106	R104-E106 WeakPolarHBondContact CD-OE1 3.02Å; R104-E106 VanDerWaalsContact CG-OE1 3.24Å; R104-E106 WeakPolarHBondContact CG-OE1 3.24Å; R104-E106 IonicContact CZ-OE1 2.71Å; R104-E106 IonicContact CZ-OE2 2.69Å; R104-E106 IonicContact NE-OE1 3.64Å; R104-E106 PolarHBondContact NE-OE1 2.72Å; R104-E106 IonicContact NE-OE2 3.9Å; R104-E106 PolarHBondContact NE-OE2 2.79Å; R104-E106 IonicContact NH2-OE1 3.8Å; R104-E106 IonicContact NH2-OE2 2.67Å; R104-E106 PolarHBondContact NH2-OE2 2.91Å
105	I	29.8	Very low	33.8	Very low	162 Å²	162	154.1 Å²	154.1	83%	0.831	76%	0.757	S	S	*	*			trans	-155.8	175.9	159.7	-157.8	163.3	0	0	0	110.8
106	E	31.7	Very low	33.6	Very low	118 Å²	118	152.6 Å²	152.6	55%	0.551	75%	0.752	S	S	*	*			trans	-125.5	-155.2	-172.8	-28.4	-64.3	118	0	0	113.6	R104	R104-E106 WeakPolarHBondContact CD-OE1 3.02Å; R104-E106 VanDerWaalsContact CG-OE1 3.24Å; R104-E106 WeakPolarHBondContact CG-OE1 3.24Å; R104-E106 IonicContact CZ-OE1 2.71Å; R104-E106 IonicContact CZ-OE2 2.69Å; R104-E106 IonicContact NE-OE1 3.64Å; R104-E106 PolarHBondContact NE-OE1 2.72Å; R104-E106 IonicContact NE-OE2 3.9Å; R104-E106 PolarHBondContact NE-OE2 2.79Å; R104-E106 IonicContact NH2-OE1 3.8Å; R104-E106 IonicContact NH2-OE2 2.67Å; R104-E106 PolarHBondContact NH2-OE2 2.91Å
107	Q	32.2	Very low	33.5	Very low	175 Å²	175	149.7 Å²	149.7	82%	0.818	75%	0.754	S	S	*	*			trans	84.7	130.9	-174.8	-62.8	-166.2	-89.5	0	0	116
108	D	29.7	Very low	34.5	Very low	107 Å²	107	146.2 Å²	146.2	57%	0.572	75%	0.75	S	S	*	*			cis	-156.5	158.5	-0.1	-126.7	-27.9	0	0	0	114.9
109	H	31.2	Very low	34	Very low	146 Å²	146	145.6 Å²	145.6	68%	0.676	75%	0.75	S	S	*	*			trans	51.5	149.1	162.2	-65.5	-68.6	0	0	0	121.5
110	Q	28.8	Very low	33.1	Very low	167 Å²	167	145.8 Å²	145.8	78%	0.78	75%	0.754	S	S	*	*			cis	-158.1	-171.1	-27.2	-130.6	168.7	24.2	0	0	110.7
111	T	26.7	Very low	33.1	Very low	130 Å²	130	145.2 Å²	145.2	80%	0.798	75%	0.753	S	S	*	*			trans	-124.7	-159.2	-162.8	60.5	0	0	0	0	112.3
112	P	52.1	Low	33.6	Very low	104 Å²	104	144.9 Å²	144.9	68%	0.675	75%	0.753	S	S	*	*			cis	-144.4	-156.2	-2.9	30.9	-2.9	0	0	0	116.3
113	I	28.2	Very low	32.4	Very low	157 Å²	157	144.2 Å²	144.2	81%	0.805	75%	0.751	S	S	*	*			trans	105.3	158.7	155.4	-59.7	158.8	0	0	0	117.5
114	R	30.2	Very low	32.6	Very low	214 Å²	214	142.5 Å²	142.5	81%	0.808	74%	0.742	S	S	*	*				-170.8	129.5	-72.1	-132.4	-174.4	-175.8	-174.9	3.5	111.9
115	K	28.3	Very low	32.5	Very low	168 Å²	168	139.9 Å²	139.9	73%	0.73	74%	0.738	S	S	*	*			trans	58.3	118.8	151.2	-75.7	-175.3	169	-167	0	124.1
116	L	26.6	Very low	32.5	Very low	153 Å²	153	137.9 Å²	137.9	80%	0.801	73%	0.73	S	S	*	*				65	129.3	122.6	-69	163.5	0	0	0	125.6
117	A	27.8	Very low	32.4	Very low	90 Å²	90	140.1 Å²	140.1	74%	0.744	74%	0.74	S	S	*	*			trans	77.4	160.7	135.6	0	0	0	0	0	121.4
118	P	51.8	Low	32.1	Very low	108 Å²	108	137.6 Å²	137.6	70%	0.701	74%	0.736	S	S	*	*			cis	-139.4	-165.5	-33.2	38.4	-18.5	0	0	0	115.4
119	E	27.8	Very low	32.3	Very low	187 Å²	187	138.3 Å²	138.3	87%	0.874	75%	0.745	S	S	*	*			trans	76.3	148.4	163.6	-70	176.5	-148.7	0	0	118.8
120	S	28.7	Very low	33.8	Very low	114 Å²	114	137 Å²	137	80%	0.797	75%	0.749	S	S	*	*			cis	-147.7	165.9	2	58	0	0	0	0	114.6
121	I	30.5	Very low	34.6	Very low	148 Å²	148	134.4 Å²	134.4	76%	0.759	75%	0.747	S	S	*	*			trans	-95.8	156.7	174.1	-84	169.1	0	0	0	109.2
122	P	45.5	Very low	34.7	Very low	116 Å²	116	136.1 Å²	136.1	75%	0.753	75%	0.748	S	S	*	*			cis	-124.3	153.5	33.8	22.7	1.8	0	0	0	116.6
123	S	31.9	Very low	33.8	Very low	91 Å²	91	142.2 Å²	142.2	64%	0.636	76%	0.757	S	S	*	*			cis	77.3	146.3	39	-151.9	0	0	0	0	111.9
124	L	33.3	Very low	34	Very low	134 Å²	134	146.4 Å²	146.4	70%	0.702	76%	0.763	S	S	*	*			cis	-115.3	-131.2	17.7	-49.5	92.3	0	0	0	112.1
125	E	29.8	Very low	34.2	Very low	148 Å²	148	141.4 Å²	141.4	69%	0.692	76%	0.761	S	S	*	*			cis	-153.5	-137.9	7	-158.3	68.6	-79.9	0	0	111.1
126	D	30.6	Very low	34.3	Very low	121 Å²	121	138.7 Å²	138.7	65%	0.647	76%	0.763	S	S	*	*			trans	-68.5	134.8	-166.7	-78.3	-40.8	0	0	0	116.1
127	Q	28.6	Very low	34.6	Very low	164 Å²	164	137.5 Å²	137.5	77%	0.766	77%	0.767	S	S	*	*				77.6	136.9	58.7	-67.7	-165.1	101.2	0	0	114.2
128	V	27.1	Very low	34.6	Very low	123 Å²	123	136.7 Å²	136.7	75%	0.745	77%	0.767	S	S	*	*			cis	-153.4	164	-0.2	109.3	0	0	0	0	112.3
129	T	33.5	Very low	33.7	Very low	122 Å²	122	136.5 Å²	136.5	75%	0.748	77%	0.769	S	S	*	*			trans	-82.2	164.9	-177.8	29.9	0	0	0	0	116.5
130	P	61.1	Low	33.8	Very low	118 Å²	118	135.3 Å²	135.3	77%	0.766	77%	0.765	S	S	*	*			trans	-78.5	173.3	-176.9	34.9	-39.6	0	0	0	114
131	P	47	Very low	34	Very low	113 Å²	113	136.6 Å²	136.6	73%	0.734	76%	0.762	S	S	*	*				-156.8	158.1	124.9	39.6	-21.6	0	0	0	119.6
132	M	27.5	Very low	34.1	Very low	165 Å²	165	137.3 Å²	137.3	81%	0.813	77%	0.767	S	S	*	*			trans	40.4	133.6	133.6	-63.4	166.9	43.2	0	0	125.5
133	R	35.1	Very low	33.4	Very low	232 Å²	232	142.4 Å²	142.4	88%	0.875	77%	0.771	S	S	*	*			trans	-1.2	135.7	137.9	-57.2	179.3	178.2	-147.3	1	119.1
134	R	31.3	Very low	33.4	Very low	246 Å²	246	147.1 Å²	147.1	93%	0.928	78%	0.783	S	S	*	*				-171.6	177.3	111.9	-104.1	172.5	-165.5	-111.9	4.2	113.3
135	S	34.7	Very low	33.6	Very low	109 Å²	109	147 Å²	147	76%	0.762	79%	0.788	S	S	*	*			trans	-106.8	149	-166.8	53.9	0	0	0	0	114.8
136	S	31.2	Very low	34.2	Very low	110 Å²	110	145.4 Å²	145.4	77%	0.769	79%	0.79	S	S	*	*			trans	-168.8	132.7	144.6	55.9	0	0	0	0	114.9
137	S	31.5	Very low	34.3	Very low	129 Å²	129	147.8 Å²	147.8	90%	0.902	80%	0.798	S	S	*	*			trans	25.2	139.2	134.5	-44.2	0	0	0	0	122.3
138	G	28.8	Very low	34.5	Very low	72 Å²	72	150.4 Å²	150.4	74%	0.742	80%	0.8	S	S	*	*			trans	163.3	81.9	155	0	0	0	0	0	119.7
139	S	32.8	Very low	34.9	Very low	104 Å²	104	150 Å²	150	73%	0.727	79%	0.793	S	S	*	*			trans	8.7	128	149.8	57.6	0	0	0	0	123.2
140	M	30.3	Very low	35	Very low	162 Å²	162	153.7 Å²	153.7	80%	0.798	79%	0.793	S	S	*	*				63.6	131	127.8	-68.1	170.7	57.5	0	0	123.2
141	L	33.1	Very low	33.8	Very low	142 Å²	142	154.7 Å²	154.7	74%	0.743	78%	0.782	S	S	*	*			trans	54.3	110.1	140	-63.4	176.3	0	0	0	119.7
142	L	31.6	Very low	32.9	Very low	163 Å²	163	155.4 Å²	155.4	85%	0.853	78%	0.775	S	S	*	*				-164.6	176.8	88.7	-139.4	65.9	0	0	0	112.4
143	R	30.6	Very low	33.1	Very low	223 Å²	223	152.4 Å²	152.4	84%	0.842	76%	0.759	S	S	*	*			trans	-81.7	145.9	169.6	-58.5	164.2	169.7	165.3	-7.4	110
144	Q	32.3	Very low	32.9	Very low	190 Å²	190	148.9 Å²	148.9	89%	0.888	75%	0.752	S	S	*	*				174	126.3	112.2	-93.6	166.6	15.4	0	0	113.5
145	T	36.8	Very low	32.8	Very low	130 Å²	130	144.1 Å²	144.1	80%	0.798	75%	0.745	S	S	*	*			trans	-72.8	159.4	153.6	48.4	0	0	0	0	109.2
146	P	42.9	Very low	32.7	Very low	115 Å²	115	144.9 Å²	144.9	75%	0.747	75%	0.745	S	S	*	*				-155.6	166.1	59.7	42.7	-21.4	0	0	0	120
147	E	32.8	Very low	32.7	Very low	171 Å²	171	148.5 Å²	148.5	80%	0.799	75%	0.75	S	S	*	*				17.6	140.9	125.5	-137.3	65.4	-154.3	0	0	120.8
148	R	33	Very low	32.9	Very low	219 Å²	219	148.9 Å²	148.9	83%	0.826	75%	0.747	S	S	*	*			trans	146.1	157.6	136.6	-83.7	-166.8	161.9	171.1	-4.8	113.7
149	I	35.3	Very low	33.6	Very low	114 Å²	114	151.4 Å²	151.4	59%	0.585	75%	0.75	S	S	*	*			cis	-176	167.5	-23.4	-160.4	165.2	0	0	0	108.4
150	R	34.5	Very low	33.4	Very low	201 Å²	201	150.3 Å²	150.3	76%	0.758	76%	0.756	S	S	*	*				166.4	148.7	129.5	-91.3	-167.6	100.9	94.4	1.8	110.1
151	R	36.4	Very low	33.4	Very low	139 Å²	139	147.9 Å²	147.9	53%	0.525	76%	0.755	S	S	.	*			cis	178.6	159	-24.2	-126.7	-174.8	171.5	-111.6	-15.5	106.2	E153	R151-E153 IonicContact CZ-OE1 2.85Å; R151-E153 IonicContact CZ-OE2 3.04Å; R151-E153 IonicContact NE-OE1 3.41Å; R151-E153 PolarHBondContact NE-OE1 3.34Å; R151-E153 VanDerWaalsContact NH1-CD 3.27Å; R151-E153 IonicContact NH1-OE1 3.02Å; R151-E153 PolarHBondContact NH1-OE1 3.49Å; R151-E153 IonicContact NH1-OE2 2.71Å; R151-E153 PolarHBondContact NH1-OE2 3.31Å; R151-E153 IonicContact NH2-OE1 2.92Å; R151-E153 PolarHBondContact NH2-OE1 3.41Å; R151-E153 IonicContact NH2-OE2 2.71Å; R151-E153 PolarHBondContact NH2-OE2 3.27Å
152	Q	28.8	Very low	34	Very low	127 Å²	127	146.6 Å²	146.6	59%	0.593	76%	0.755	S	S	*	*			cis	-144.4	175.9	12.5	-54.3	-161.7	147.8	0	0	109.2
153	E	30.9	Very low	33.9	Very low	102 Å²	102	144 Å²	144	48%	0.477	75%	0.746	S	S	.	*			cis	-120.7	-72.9	-20.9	-157.5	75.6	-47.3	0	0	112.9	R151	R151-E153 IonicContact CZ-OE1 2.85Å; R151-E153 IonicContact CZ-OE2 3.04Å; R151-E153 IonicContact NE-OE1 3.41Å; R151-E153 PolarHBondContact NE-OE1 3.34Å; R151-E153 VanDerWaalsContact NH1-CD 3.27Å; R151-E153 IonicContact NH1-OE1 3.02Å; R151-E153 PolarHBondContact NH1-OE1 3.49Å; R151-E153 IonicContact NH1-OE2 2.71Å; R151-E153 PolarHBondContact NH1-OE2 3.31Å; R151-E153 IonicContact NH2-OE1 2.92Å; R151-E153 PolarHBondContact NH2-OE1 3.41Å; R151-E153 IonicContact NH2-OE2 2.71Å; R151-E153 PolarHBondContact NH2-OE2 3.27Å
154	E	30.3	Very low	33.7	Very low	158 Å²	158	141.9 Å²	141.9	74%	0.738	74%	0.743	S	S	*	*			cis	-159.8	161	-18.2	-139.8	133	-66.9	0	0	110.4
155	D	30.9	Very low	33.5	Very low	146 Å²	146	143.2 Å²	143.2	78%	0.781	74%	0.739	S	S	*	*			trans	-111.5	163	-159.3	-48.6	-52.5	0	0	0	113.9
156	V	30.9	Very low	32.8	Very low	125 Å²	125	147.2 Å²	147.2	76%	0.758	74%	0.741	S	S	*	*			cis	-151.1	128.4	31.2	175.5	0	0	0	0	113.5
157	E	32.4	Very low	32.1	Very low	186 Å²	186	150.7 Å²	150.7	87%	0.869	74%	0.74	S	S	*	*			trans	57.2	168.4	149.5	-61.2	-171.9	155.7	0	0	125.7
158	T	35.4	Very low	31.9	Very low	137 Å²	137	152.1 Å²	152.1	84%	0.84	74%	0.738	S	S	*	*			trans	-127.5	-159.9	-160.7	20.1	0	0	0	0	111
159	P	43	Very low	31.9	Very low	125 Å²	125	147.4 Å²	147.4	81%	0.812	74%	0.738	S	S	*	*			cis	-136	-177.3	-6.9	41.1	-22.7	0	0	0	116.7
160	G	29.8	Very low	31.5	Very low	82 Å²	82	144.1 Å²	144.1	85%	0.845	73%	0.733	S	S	*	*			trans	127.3	124.3	136.9	0	0	0	0	0	120.3
161	S	29.9	Very low	31.3	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	72%	0.718	S	S	*	*			trans	-117.3	155.2	167.4	-177.7	0	0	0	0	110.4
162	P	45.4	Very low	31.5	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	73%	0.73	S	S	*	*				-158.2	132.5	121.1	35	-13.6	0	0	0	120.2
163	V	28.7	Very low	32.4	Very low	108 Å²	108	136.4 Å²	136.4	66%	0.655	73%	0.727	S	S	*	*				61.6	111.2	114.6	-177	0	0	0	0	123.1
164	K	27.3	Very low	32.7	Very low	179 Å²	179	140.1 Å²	140.1	78%	0.778	74%	0.737	S	S	*	*			trans	74.9	144.5	137.4	-71.3	170.5	-165.1	158.9	0	125.3
165	R	27	Very low	32.9	Very low	218 Å²	218	135.9 Å²	135.9	82%	0.823	72%	0.719	S	S	*	*			trans	90.7	106	136.6	-86.3	171.2	-179.6	-176.7	1	123.2
166	Y	23.4	Very low	33.1	Very low	213 Å²	213	133.1 Å²	133.1	84%	0.835	70%	0.701	S	S	*	*				68.8	135.9	115.9	-108.1	-63.6	0	0	0	124.1
167	R	28.1	Very low	33.3	Very low	189 Å²	189	130 Å²	130	71%	0.713	69%	0.689	S	S	*	*			trans	94.2	112.3	147.5	-71.1	-160.5	170.4	-170.1	-3.2	122.7
168	R	29.3	Very low	33.4	Very low	200 Å²	200	130.3 Å²	130.3	76%	0.755	69%	0.69	S	S	*	*				79.4	122	122.6	-74.2	-169.9	170.8	-162.9	-5.9	123
169	S	31.1	Very low	33.3	Very low	120 Å²	120	128.4 Å²	128.4	84%	0.839	68%	0.683	S	S	*	*				73.2	153.8	127.4	73.1	0	0	0	0	121.8
170	G	27.4	Very low	32.9	Very low	46 Å²	46	129.8 Å²	129.8	47%	0.474	68%	0.683	S	S	.	*			trans	139.6	128.2	165.6	0	0	0	0	0	113.9	K401	G170-K401 WeakPolarHBondContact O-CD 3.39Å; G170-K401 WeakPolarHBondContact O-CE 3.3Å; G170-K401 PolarHBondContact O-NZ 3.3Å
171	S	31.8	Very low	32.8	Very low	63 Å²	63	132.4 Å²	132.4	44%	0.441	68%	0.677	S	S	.	*			trans	-82.3	-176	-177.3	-159.5	0	0	0	0	114.3	D399	S171-D399 WeakPolarHBondContact CB-OD2 3.15Å; S171-D399 PolarHBondContact OG-OD2 2.77Å
172	M	39	Very low	33	Very low	159 Å²	159	133 Å²	133	78%	0.783	68%	0.676	S	S	*	*			trans	-86.5	-142.5	176.8	-64.1	-78.5	-89.4	0	0	108.2
173	P	49.3	Very low	32.7	Very low	82 Å²	82	133.4 Å²	133.4	53%	0.532	68%	0.679	S	S	.	*			cis	-145.7	-163.2	-11.4	44.7	-24.4	0	0	0	116.2
174	R	36.4	Very low	33.2	Very low	181 Å²	181	135.5 Å²	135.5	68%	0.683	68%	0.684	S	S	*	*			trans	70.3	145	148.7	-73.2	-166.7	109.8	144.4	-4.1	119.8	S202	R174-S202 PolarHBondContact O-N 2.7Å
175	L	34.6	Very low	33.6	Very low	68 Å²	68	137.3 Å²	137.3	36%	0.356	69%	0.686	S	S	.	*			cis	-166.3	167.2	4.2	-108.3	164.5	0	0	0	112	S203	L175-S203 WeakPolarHBondContact O-CA 3.07Å
176	E	34.1	Very low	33.9	Very low	88 Å²	88	133.3 Å²	133.3	41%	0.411	68%	0.679	S	S	.	*			trans	40.9	158.9	142.3	-70	160.5	-51.9	0	0	122.7	L204 T205 C206	E176-L204 CarbonylContact C-O 3.44Å; E176-L204 VanDerWaalsContact CB-C 3.49Å; E176-L204 WeakPolarHBondContact CB-O 3.37Å; E176-T205 VanDerWaalsContact CD-CA 3.49Å; E176-T205 WeakPolarHBondContact OE2-CA 3.48Å; E176-C206 PolarHBondContact OE2-N 3.45Å
177	A	35.3	Very low	34.4	Very low	61 Å²	61	130 Å²	130	50%	0.504	67%	0.671	S	S	.	*			cis	-156.1	156.1	-6.1	0	0	0	0	0	108.3	L204	A177-L204 VanDerWaalsContact CB-O 3.24Å; A177-L204 WeakPolarHBondContact CB-O 3.38Å; A177-L204 PolarHBondContact N-O 2.75Å
178	Q	34.2	Very low	34.6	Very low	192 Å²	192	128 Å²	128	90%	0.897	67%	0.672	S	S	*	*				40.8	134.6	83.7	-64.8	179	0.1	0	0	115.5
179	S	34.1	Very low	34.7	Very low	97 Å²	97	121.3 Å²	121.3	68%	0.678	67%	0.666	S	S	*	*			cis	-167.7	159	0.6	52.9	0	0	0	0	112.8
180	L	34.6	Very low	34.8	Very low	154 Å²	154	123.7 Å²	123.7	81%	0.806	67%	0.67	S	S	*	*			trans	68.2	149.6	170.6	-56.3	172.7	0	0	0	115.4
181	D	28.9	Very low	35.2	Very low	136 Å²	136	126.1 Å²	126.1	73%	0.727	68%	0.679	S	S	*	*			cis	-144	176.9	15.5	-118.9	-37.5	0	0	0	114.6
182	V	34.1	Very low	35.3	Very low	124 Å²	124	131.2 Å²	131.2	75%	0.752	70%	0.701	S	S	*	*			trans	-48.2	134.1	-175.1	171.8	0	0	0	0	117.8
183	P	38.9	Very low	35.3	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	70%	0.7	S	S	*	*				-138.9	-168.1	114	36.6	-21.4	0	0	0	115.2
184	I	38	Very low	35.4	Very low	152 Å²	152	131 Å²	131	78%	0.779	71%	0.709	S	S	*	*			trans	-113	140.7	-151.9	-62	169.3	0	0	0	115.6
185	R	35.3	Very low	34.9	Very low	216 Å²	216	128 Å²	128	82%	0.815	71%	0.711	S	S	*	*			trans	76.4	138.6	158.7	-98.9	-176.3	166.2	172.5	-4.3	122
186	M	33.6	Very low	34.5	Very low	135 Å²	135	130.9 Å²	130.9	67%	0.665	73%	0.726	S	S	*	*			trans	67.7	158.6	149.6	-66.7	169.5	72.9	0	0	116.3
187	E	34	Very low	34.1	Very low	142 Å²	142	134.4 Å²	134.4	66%	0.664	74%	0.74	S	S	*	*			cis	-159.6	164.7	-9.7	-126.9	-177.3	177.5	0	0	111
188	I	33.2	Very low	33.9	Very low	147 Å²	147	142.1 Å²	142.1	75%	0.754	76%	0.755	S	S	*	*			trans	61.9	152.1	153	-64.4	163.2	0	0	0	118.5
189	G	31.6	Very low	33.5	Very low	60 Å²	60	142.4 Å²	142.4	62%	0.619	75%	0.754	S	S	*	*			trans	-146.2	179.4	172.1	0	0	0	0	0	112.7
190	N	32.9	Very low	33.4	Very low	171 Å²	171	148.8 Å²	148.8	91%	0.914	76%	0.763	S	S	*	*			trans	-163.4	168	167.1	-107	-36.9	0	0	0	112
191	S	36	Very low	33.3	Very low	97 Å²	97	146.4 Å²	146.4	68%	0.678	76%	0.755	S	S	*	*			trans	-101	153.4	-167.9	57.7	0	0	0	0	115.4
192	L	33.3	Very low	33.4	Very low	170 Å²	170	144.2 Å²	144.2	89%	0.89	75%	0.75	S	S	*	*			trans	158	153.2	134.8	-84.9	162	0	0	0	112.1
193	T	38	Very low	33.7	Very low	126 Å²	126	140.9 Å²	140.9	77%	0.773	73%	0.732	S	S	*	*			trans	-88.9	174.1	168	62.7	0	0	0	0	110.3
194	P	51.5	Low	33.5	Very low	109 Å²	109	141 Å²	141	71%	0.708	73%	0.726	S	S	*	*			cis	-147.7	-155	14.8	39	-13.9	0	0	0	115.3
195	V	26.6	Very low	33.7	Very low	120 Å²	120	137.7 Å²	137.7	73%	0.727	71%	0.713	S	S	*	*			trans	80.9	113.8	141.5	153.8	0	0	0	0	121.9
196	L	26	Very low	33.9	Very low	128 Å²	128	131.9 Å²	131.9	67%	0.67	70%	0.704	S	S	*	*			trans	62.5	124.6	141.7	-63.8	179.2	0	0	0	124.7
197	K	25.3	Very low	33.9	Very low	162 Å²	162	132 Å²	132	70%	0.704	71%	0.707	S	S	*	*				83.2	126.8	128.8	-77.5	167.5	-178.4	156.9	0	122
198	R	31.8	Very low	33.8	Very low	222 Å²	222	134.1 Å²	134.1	84%	0.838	71%	0.714	S	S	*	*			trans	94.3	100.7	144.7	-71.1	166.5	174.8	153.5	-4.6	120.8
199	K	26.5	Very low	33.6	Very low	198 Å²	198	132 Å²	132	86%	0.861	71%	0.713	S	S	*	*				42.8	107.9	121.8	-61.5	-173.6	176.7	-169	0	119.1
200	R	31.8	Very low	33.5	Very low	232 Å²	232	134 Å²	134	88%	0.875	72%	0.717	S	S	*	*				-178.9	114	109.3	-102.2	167.5	173.7	158.5	-3.9	113.8
201	T	31.5	Very low	33.4	Very low	103 Å²	103	133.6 Å²	133.6	63%	0.632	72%	0.715	S	S	*	*				49	138.9	122.8	58.8	0	0	0	0	122.9
202	S	32.6	Very low	33.1	Very low	90 Å²	90	136.6 Å²	136.6	63%	0.629	72%	0.72	S	S	*	*			trans	69.2	143.8	153.9	50	0	0	0	0	118.8	R174	R174-S202 PolarHBondContact O-N 2.7Å
203	S	40.3	Very low	34.4	Very low	54 Å²	54	133.6 Å²	133.6	38%	0.378	71%	0.711	S	S	.	*			cis	148.1	105.3	-24	56.5	0	0	0	0	111.8	L175	L175-S203 WeakPolarHBondContact O-CA 3.07Å
204	L	32.9	Very low	35	Very low	128 Å²	128	132.4 Å²	132.4	67%	0.67	71%	0.705	S	S	*	*			trans	-163.9	141.1	163	-74.4	-175.9	0	0	0	110.6	E176 A177	E176-L204 CarbonylContact C-O 3.44Å; E176-L204 VanDerWaalsContact CB-C 3.49Å; E176-L204 WeakPolarHBondContact CB-O 3.37Å; A177-L204 VanDerWaalsContact CB-O 3.24Å; A177-L204 WeakPolarHBondContact CB-O 3.38Å; A177-L204 PolarHBondContact N-O 2.75Å
205	T	42.8	Very low	33.8	Very low	82 Å²	82	134.9 Å²	134.9	50%	0.503	71%	0.711	S	S	.	*			cis	-171.2	134.4	-46.3	19.2	0	0	0	0	112	E176	E176-T205 VanDerWaalsContact CD-CA 3.49Å; E176-T205 WeakPolarHBondContact OE2-CA 3.48Å
206	C	38.9	Very low	34.3	Very low	93 Å²	93	136.6 Å²	136.6	63%	0.628	72%	0.715	S	S	*	*			trans	73.5	160.7	162.1	-57.3	0	0	0	0	116.4	E176	E176-C206 PolarHBondContact OE2-N 3.45Å
207	L	33.6	Very low	34.9	Very low	139 Å²	139	136.4 Å²	136.4	73%	0.728	72%	0.719	S	S	*	*				-159.8	174.6	52	-88.9	169.5	0	0	0	116.1
208	F	32.2	Very low	36.4	Very low	185 Å²	185	134 Å²	134	81%	0.811	72%	0.72	S	S	*	*			trans	81.6	160.5	168	-56.9	-64.1	0	0	0	118.5
209	S	30.5	Very low	36.2	Very low	104 Å²	104	131.9 Å²	131.9	73%	0.727	72%	0.72	S	S	*	*			trans	-153.4	160.1	-134.9	-53	0	0	0	0	115.3
210	S	29.3	Very low	36.6	Very low	101 Å²	101	132.8 Å²	132.8	71%	0.706	72%	0.718	S	S	*	*			trans	62	127.3	157.8	39.6	0	0	0	0	117.8
211	D	29.2	Very low	36.8	Very low	162 Å²	162	128.1 Å²	128.1	87%	0.866	71%	0.709	S	S	*	*			cis	-143.4	151.4	3	-82.4	-41.4	0	0	0	113.1
212	M	30.5	Very low	37.2	Very low	161 Å²	161	134 Å²	134	79%	0.793	72%	0.72	S	S	*	*			trans	-160	153.6	177.6	-140.6	-92.8	166.1	0	0	110.3
213	P	60.8	Low	37.6	Very low	107 Å²	107	136.1 Å²	136.1	70%	0.695	73%	0.732	S	S	*	*			trans	-90.4	-126.8	162.4	42.7	-39.9	0	0	0	108
214	P	51.1	Low	37.4	Very low	101 Å²	101	145.4 Å²	145.4	66%	0.656	76%	0.758	S	S	*	*			cis	-80.6	-163	-23.5	40.3	-37.8	0	0	0	111.2
215	I	26.5	Very low	37.2	Very low	161 Å²	161	143.1 Å²	143.1	83%	0.826	77%	0.766	S	S	*	*			trans	-152	137.3	139.3	-96.9	147.9	0	0	0	110.3
216	L	36.3	Very low	36.8	Very low	156 Å²	156	147.6 Å²	147.6	82%	0.817	79%	0.785	S	S	*	*			trans	-135.2	110.8	165.3	-82.2	173.6	0	0	0	110.1
217	T	39.6	Very low	36.4	Very low	123 Å²	123	147.6 Å²	147.6	76%	0.755	79%	0.785	S	S	*	*			trans	63.9	-176.5	163.5	77.7	0	0	0	0	115.4
218	P	55.5	Low	36.3	Very low	112 Å²	112	149.3 Å²	149.3	73%	0.727	79%	0.79	S	S	*	*			cis	-136.4	-156.7	-6.2	36.4	-13.4	0	0	0	115.1
219	Q	27.3	Very low	36.3	Very low	177 Å²	177	145.7 Å²	145.7	83%	0.827	78%	0.783	S	S	*	*			trans	87.6	165.4	157	-74.7	-69.2	2.2	0	0	122.3
220	R	36.6	Very low	36.3	Very low	218 Å²	218	151.8 Å²	151.8	82%	0.823	79%	0.79	S	S	*	*			trans	-153.6	154.6	-147.9	-154.5	-175.5	-165.4	-163.4	7.5	115.3
221	L	34.3	Very low	36.5	Very low	134 Å²	134	153.3 Å²	153.3	70%	0.702	80%	0.795	S	S	*	*			trans	104.9	113.2	154.3	-59.1	172.4	0	0	0	122.8
222	R	41.7	Very low	36.6	Very low	227 Å²	227	152.6 Å²	152.6	86%	0.857	79%	0.79	S	S	*	*			trans	63.5	142.8	134.1	-82.4	-178.4	-178	156.1	3.9	121.7
223	P	39.7	Very low	36.6	Very low	134 Å²	134	152 Å²	152	87%	0.87	79%	0.79	S	S	*	*				-136	-157.5	71.4	40.2	-23.8	0	0	0	116
224	R	36.1	Very low	35.2	Very low	249 Å²	249	154.7 Å²	154.7	94%	0.94	80%	0.798	S	S	*	*			trans	-100.8	146.4	-170.6	-75.9	174.7	161.8	167.7	-7	113.7
225	G	29.5	Very low	34	Very low	80 Å²	80	157.4 Å²	157.4	83%	0.825	81%	0.808	S	S	*	*			trans	-169.6	133.6	164.2	0	0	0	0	0	112.9
226	I	33.5	Very low	34.1	Very low	176 Å²	176	156.1 Å²	156.1	90%	0.903	81%	0.807	S	S	*	*			trans	-78.3	148.9	178.4	-74.9	153.6	0	0	0	108.9
227	S	31.4	Very low	33.5	Very low	92 Å²	92	158.1 Å²	158.1	64%	0.643	81%	0.809	S	S	*	*			cis	-160.1	156.2	44.3	46.7	0	0	0	0	115.4
228	E	31.6	Very low	33.3	Very low	176 Å²	176	157.9 Å²	157.9	82%	0.822	81%	0.807	S	S	*	*			trans	50.4	146.8	140.3	-62	-175.4	154.6	0	0	122.2
229	T	31	Very low	32.1	Very low	109 Å²	109	158.6 Å²	158.6	67%	0.669	81%	0.812	S	S	*	*			cis	-162.6	156.3	-6.4	22.6	0	0	0	0	112.2
230	R	32	Very low	32	Very low	232 Å²	232	159.1 Å²	159.1	88%	0.875	81%	0.812	S	S	*	*			trans	66.4	146	162.2	-66	170.3	178.9	175.7	0.5	117.3
231	T	33.2	Very low	31.7	Very low	133 Å²	133	154.1 Å²	154.1	82%	0.816	81%	0.811	S	S	*	*			cis	-152.8	161.4	-10.2	6.9	0	0	0	0	109.3
232	I	31.7	Very low	32.1	Very low	146 Å²	146	152.9 Å²	152.9	75%	0.749	81%	0.81	S	S	*	*			trans	-111.1	171.5	-175.9	-9	179.7	0	0	0	109.4
233	D	29.8	Very low	31.5	Very low	150 Å²	150	148.7 Å²	148.7	80%	0.802	81%	0.81	S	S	*	*			cis	-142.2	152.7	46.6	-67.5	-56.5	0	0	0	114.1
234	D	31.3	Very low	30.9	Very low	162 Å²	162	151.5 Å²	151.5	87%	0.866	81%	0.809	S	S	*	*			trans	-120.4	149.5	166.6	-95.7	-52.7	0	0	0	108.7
235	D	26.3	Very low	30.6	Very low	159 Å²	159	149.1 Å²	149.1	85%	0.85	81%	0.805	S	S	*	*			trans	-142.4	84.4	-175	-160	5.7	0	0	0	114.5
236	V	27.7	Very low	30.8	Very low	134 Å²	134	150.6 Å²	150.6	81%	0.812	80%	0.8	S	S	*	*			trans	-144.7	139	164.5	-161.4	0	0	0	0	112.2
237	F	24	Very low	30.5	Very low	197 Å²	197	149.3 Å²	149.3	86%	0.864	79%	0.794	S	S	*	*			trans	90	146.5	162.7	-114.2	-81.5	0	0	0	120.4
238	V	34.4	Very low	30.5	Very low	118 Å²	118	151.8 Å²	151.8	72%	0.715	81%	0.805	S	S	*	*			trans	-122.4	136.5	-159.5	172	0	0	0	0	112.7
239	P	30.8	Very low	30.5	Very low	128 Å²	128	148.4 Å²	148.4	83%	0.831	80%	0.801	S	S	*	*			trans	-134.8	-170.4	138.5	24.2	-3.2	0	0	0	113.8
240	K	26.4	Very low	30.8	Very low	187 Å²	187	149.1 Å²	149.1	81%	0.813	81%	0.807	S	S	*	*			trans	-128.3	153.3	-155.3	-55	168.7	-177	164.9	0	115.7
241	S	28.9	Very low	30.7	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	80%	0.802	S	S	*	*			trans	71.6	168.2	145.2	82.1	0	0	0	0	116.7
242	P	42.4	Very low	30.7	Very low	107 Å²	107	148.5 Å²	148.5	70%	0.695	81%	0.805	S	S	*	*			cis	-117.6	164	5.8	39.4	-24.4	0	0	0	114.8
243	T	29.1	Very low	30.7	Very low	139 Å²	139	151.3 Å²	151.3	85%	0.853	81%	0.812	S	S	*	*				-166.4	165.9	90.6	25.7	0	0	0	0	115.1
244	K	28.3	Very low	30.7	Very low	193 Å²	193	155.4 Å²	155.4	84%	0.839	82%	0.816	S	S	*	*			trans	-57.8	136	-164.9	-55.2	168.2	179.6	179.5	0	116.7
245	K	28.7	Very low	30.6	Very low	200 Å²	200	153.8 Å²	153.8	87%	0.87	81%	0.812	S	S	*	*			trans	39.8	154.7	133.7	-61.5	-175.3	179.8	-178.2	0	120.3
246	P	33.9	Very low	30.6	Very low	110 Å²	110	156.9 Å²	156.9	71%	0.714	81%	0.812	S	S	*	*			cis	-142.7	174.8	21.3	43.1	-23.7	0	0	0	118.6
247	I	27.3	Very low	30.7	Very low	150 Å²	150	156.9 Å²	156.9	77%	0.769	80%	0.802	S	S	*	*			trans	39.8	115.8	146	-58.3	158.7	0	0	0	120.4
248	T	31.8	Very low	30.8	Very low	144 Å²	144	153.6 Å²	153.6	88%	0.883	79%	0.794	S	S	*	*				-177.4	163.4	122.2	22	0	0	0	0	111.5
249	S	31.2	Very low	30.6	Very low	104 Å²	104	153.9 Å²	153.9	73%	0.727	80%	0.801	S	S	*	*			trans	-110.7	146.7	-177.3	58.4	0	0	0	0	113.3
250	P	37.1	Very low	30.5	Very low	124 Å²	124	156.4 Å²	156.4	81%	0.805	80%	0.802	S	S	*	*			trans	-105.1	90.5	174.9	36.3	-29.8	0	0	0	112.7
251	I	30.8	Very low	30.6	Very low	151 Å²	151	155 Å²	155	77%	0.774	80%	0.804	S	S	*	*			trans	-74.8	125.4	161.8	-74.1	179.8	0	0	0	109.1	K253	I251-K253 PolarHBondContact O-N 3.47Å
252	K	31.9	Very low	30.5	Very low	201 Å²	201	160.6 Å²	160.6	87%	0.874	81%	0.807	S	S	*	*			trans	-67	122.4	173.9	-61.3	172.7	-177.9	173.5	0	110.5
253	K	32.2	Very low	29.9	Very low	206 Å²	206	160.1 Å²	160.1	90%	0.896	81%	0.807	S	S	*	*			trans	-129.5	163.1	150.4	-82.3	-166.7	176.2	177.3	0	111.2	I251	I251-K253 PolarHBondContact O-N 3.47Å
254	R	31.1	Very low	29.9	Very low	236 Å²	236	159.7 Å²	159.7	89%	0.891	80%	0.804	S	S	*	*			trans	-118.7	123.3	-148.3	-170.5	-174.8	-155.9	160.9	4.2	111.4
255	V	27.5	Very low	29.9	Very low	127 Å²	127	155.5 Å²	155.5	77%	0.77	80%	0.799	S	S	*	*			trans	14.7	115.9	151.8	-172.8	0	0	0	0	117.6
256	R	28	Very low	30.7	Very low	225 Å²	225	150.9 Å²	150.9	85%	0.849	79%	0.789	S	S	*	*			trans	163	156	139.4	-93.9	178.3	172.7	151.8	0	109.1
257	Q	28.4	Very low	30.6	Very low	133 Å²	133	152.3 Å²	152.3	62%	0.621	79%	0.79	S	S	*	*			cis	-171.5	162.1	-34.5	-133.9	-175.3	-81.4	0	0	107.5
258	D	26.5	Very low	31	Very low	128 Å²	128	153.7 Å²	153.7	68%	0.684	79%	0.791	S	S	*	*			trans	72.4	162	153.7	-50.7	-27.6	0	0	0	121.8
259	S	31.1	Very low	31.1	Very low	124 Å²	124	154.8 Å²	154.8	87%	0.867	78%	0.783	S	S	*	*			trans	74.9	107.1	177	65.2	0	0	0	0	118.5
260	E	26.8	Very low	31.2	Very low	181 Å²	181	160.9 Å²	160.9	85%	0.846	79%	0.79	S	S	*	*			trans	-83.3	163.3	172.2	-52.9	158.6	107.7	0	0	111.5
261	N	29	Very low	30.8	Very low	159 Å²	159	164.2 Å²	164.2	85%	0.85	79%	0.788	S	S	*	*				-158.7	162.8	123	-115.6	-64.6	0	0	0	115
262	R	27.2	Very low	30.6	Very low	230 Å²	230	163.5 Å²	163.5	87%	0.868	78%	0.784	S	S	*	*			trans	-57.2	159.8	-177.7	-70.4	168	164.6	-174.3	-5	112.8
263	S	29.1	Very low	30.7	Very low	98 Å²	98	158.5 Å²	158.5	69%	0.685	78%	0.775	S	S	*	*				-168.7	177.5	52	63.9	0	0	0	0	117.5
264	T	29.8	Very low	31.1	Very low	129 Å²	129	153.2 Å²	153.2	79%	0.791	76%	0.763	S	S	*	*			trans	66	118.9	148.2	41.8	0	0	0	0	122
265	S	27.8	Very low	30.9	Very low	105 Å²	105	151.8 Å²	151.8	73%	0.734	76%	0.764	S	S	*	*			trans	-76.6	-174	147.9	61.1	0	0	0	0	111.2
266	P	45.6	Very low	31.2	Very low	103 Å²	103	150.6 Å²	150.6	67%	0.669	76%	0.761	S	S	*	*			cis	-143.9	-155.5	9.4	33.2	-6	0	0	0	115.7
267	L	33.2	Very low	31.2	Very low	140 Å²	140	147.6 Å²	147.6	73%	0.733	76%	0.761	S	S	*	*			trans	85.8	134.2	164.8	-50.7	176.9	0	0	0	116.6
268	K	33.8	Very low	31.4	Very low	180 Å²	180	150.2 Å²	150.2	78%	0.783	77%	0.765	S	S	*	*			cis	75	136.3	41.6	-65.3	177.9	-177.7	170	0	112.4
269	K	35.7	Very low	31.6	Very low	167 Å²	167	150.6 Å²	150.6	73%	0.726	77%	0.766	S	S	*	*			cis	-157.1	171.5	3.1	-111.5	175.7	178	-170.6	0	107.9
270	R	31.7	Very low	31.7	Very low	231 Å²	231	150.7 Å²	150.7	87%	0.872	75%	0.753	S	S	*	*			cis	-143.3	172.9	43	-45.8	174.6	-168.5	165	3	110.2
271	Y	29.5	Very low	32.2	Very low	194 Å²	194	150.9 Å²	150.9	76%	0.761	75%	0.754	S	S	*	*			cis	93.5	145.9	7.1	-142.9	-95.3	0	0	0	118.3
272	I	27.4	Very low	32.4	Very low	137 Å²	137	150.6 Å²	150.6	70%	0.703	75%	0.747	S	S	*	*			trans	83.7	112.9	-173.2	-51.4	173.2	0	0	0	112.6
273	S	33	Very low	32.6	Very low	96 Å²	96	146.1 Å²	146.1	67%	0.671	73%	0.734	S	S	*	*			cis	83.3	154.7	33.4	103.1	0	0	0	0	113.7
274	S	40.3	Very low	32.8	Very low	94 Å²	94	148.5 Å²	148.5	66%	0.657	74%	0.735	S	S	*	*			cis	-178.7	157.8	-4.3	33.9	0	0	0	0	108.4
275	F	26.8	Very low	32.9	Very low	206 Å²	206	149 Å²	149	90%	0.904	73%	0.731	S	S	*	*			trans	-164.3	166	148.1	-114.4	-74.5	0	0	0	112.9
276	S	34.1	Very low	33	Very low	102 Å²	102	150.5 Å²	150.5	71%	0.713	73%	0.726	S	S	*	*			trans	-146	171.4	-165.6	-41.4	0	0	0	0	112
277	I	28.8	Very low	32.3	Very low	163 Å²	163	153.1 Å²	153.1	84%	0.836	73%	0.727	S	S	*	*			trans	164.2	153.2	146.5	-90.3	152.8	0	0	0	110.5
278	R	32.2	Very low	32	Very low	187 Å²	187	150.1 Å²	150.1	71%	0.706	72%	0.722	S	S	*	*			cis	-177.5	164.5	-37.3	-157.1	177.5	179.8	163.7	3	110	E280	R278-E280 WeakPolarHBondContact CG-OE1 3.47Å; R278-E280 IonicContact NE-OE2 3.73Å
279	L	31.3	Very low	31.9	Very low	136 Å²	136	147.5 Å²	147.5	71%	0.712	72%	0.721	S	S	*	*			trans	82.2	114.3	164.6	-55	172.6	0	0	0	115.6
280	E	33.3	Very low	32.5	Very low	127 Å²	127	145.4 Å²	145.4	59%	0.593	73%	0.725	S	S	*	*			cis	80.8	118.5	24.9	-47	131.7	-130.1	0	0	113.5	R278	R278-E280 WeakPolarHBondContact CG-OE1 3.47Å; R278-E280 IonicContact NE-OE2 3.73Å
281	E	35.9	Very low	32.3	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.864	72%	0.719	S	S	*	*			cis	-167.6	-163.8	-16.8	-145.6	153.2	107.1	0	0	112.7
282	E	34.6	Very low	33.2	Very low	153 Å²	153	136 Å²	136	72%	0.715	72%	0.715	S	S	*	*			trans	86.5	151.4	167.3	-60.5	-152.6	133.3	0	0	122
283	K	31.7	Very low	33.2	Very low	135 Å²	135	135.9 Å²	135.9	59%	0.587	72%	0.721	S	S	*	*			cis	-155.3	139.2	7	-136.8	177.7	-179.1	74.3	0	115.6
284	E	32	Very low	32.8	Very low	149 Å²	149	139.4 Å²	139.4	70%	0.696	73%	0.729	S	S	*	*			trans	60.4	169.4	155.8	-76.1	169.7	-107.9	0	0	118.6
285	I	31.6	Very low	32.4	Very low	139 Å²	139	139.6 Å²	139.6	71%	0.713	73%	0.731	S	S	*	*			cis	-159.7	161.3	-4.5	-124.2	172.7	0	0	0	107.4
286	E	30.9	Very low	32.5	Very low	137 Å²	137	136.2 Å²	136.2	64%	0.64	73%	0.727	S	S	*	*			cis	-138.6	-98.2	-18.6	-171.9	-156.8	107.1	0	0	108.8
287	K	30.3	Very low	33.6	Very low	157 Å²	157	136.9 Å²	136.9	68%	0.683	73%	0.729	S	S	*	*			cis	-150.9	147.4	-23.3	-160.4	117.9	-164	77.2	0	113.1
288	A	27.7	Very low	33.6	Very low	77 Å²	77	138.1 Å²	138.1	64%	0.636	73%	0.734	S	S	*	*			trans	33.9	75.1	157.7	0	0	0	0	0	121.9
289	V	32	Very low	33.7	Very low	125 Å²	125	139.9 Å²	139.9	76%	0.758	74%	0.74	S	S	*	*				30	136.2	113	174.6	0	0	0	0	118.5
290	P	47.8	Very low	34.3	Very low	123 Å²	123	143 Å²	143	80%	0.799	75%	0.748	S	S	*	*			cis	-125	175.5	32.5	13.9	11.8	0	0	0	119.2
291	T	28.3	Very low	34.1	Very low	123 Å²	123	147.1 Å²	147.1	76%	0.755	76%	0.764	S	S	*	*			trans	-109	-163.5	-169.6	58.7	0	0	0	0	110
292	P	46.8	Very low	34.1	Very low	104 Å²	104	147.5 Å²	147.5	68%	0.675	76%	0.763	S	S	*	*			cis	-140	170.6	-2.3	40.1	-20.8	0	0	0	117.3
293	T	27.4	Very low	34.5	Very low	136 Å²	136	145.6 Å²	145.6	83%	0.834	77%	0.766	S	S	*	*				-178.5	167.5	112.9	28.3	0	0	0	0	111.1
294	M	26.1	Very low	34.6	Very low	169 Å²	169	144.8 Å²	144.8	83%	0.833	77%	0.773	S	S	*	*			trans	-124.2	145.1	-159	-74.8	-93.1	80.3	0	0	115.7
295	S	31.5	Very low	35	Very low	99 Å²	99	145 Å²	145	69%	0.692	78%	0.777	S	S	*	*			trans	6	132.4	143.2	-171.2	0	0	0	0	119.7
296	T	29.4	Very low	35.2	Very low	135 Å²	135	147 Å²	147	83%	0.828	78%	0.781	S	S	*	*			trans	-138.8	128.3	160.2	59.2	0	0	0	0	111.8
297	P	56.9	Low	35.7	Very low	116 Å²	116	145.7 Å²	145.7	75%	0.753	78%	0.779	S	S	*	*			trans	-118.2	117.5	168.7	34.9	-23.1	0	0	0	112.5
298	M	27.4	Very low	36.3	Very low	189 Å²	189	142.6 Å²	142.6	93%	0.931	78%	0.775	S	S	*	*			trans	-141.6	163.5	173	-83.4	-139	75.5	0	0	114.8
299	R	34	Very low	36.9	Very low	224 Å²	224	148.7 Å²	148.7	85%	0.845	78%	0.781	S	S	*	*			trans	-93.2	144	-171.3	-69.8	173.6	170.8	148.2	-4.1	113.3
300	K	45.5	Very low	37.6	Very low	200 Å²	200	145.8 Å²	145.8	87%	0.87	77%	0.77	S	S	*	*			trans	9.2	125.8	143.3	-56.1	179.7	-179.3	-177.6	0	117.6
301	F	28.9	Very low	37.5	Very low	215 Å²	215	143.8 Å²	143.8	94%	0.943	76%	0.755	S	S	*	*			trans	-133.9	162.3	147.6	-103.7	-88.4	0	0	0	111.1
302	K	35.7	Very low	38.3	Very low	192 Å²	192	142.5 Å²	142.5	84%	0.835	75%	0.748	S	S	*	*			trans	-114.3	154	176.2	-89.6	-172.2	173.3	-175.3	0	110
303	S	43.4	Very low	38.1	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	75%	0.745	S	S	*	*			trans	63.8	145.3	173.7	65.8	0	0	0	0	114.1
304	T	34	Very low	38.9	Very low	118 Å²	118	146.7 Å²	146.7	72%	0.724	74%	0.74	S	S	*	*			cis	-152.7	161	44.4	41.8	0	0	0	0	113.8
305	I	38.7	Very low	39.8	Very low	153 Å²	153	144.3 Å²	144.3	79%	0.785	73%	0.73	S	S	*	*			trans	29.9	112.5	142.1	-52.4	167.6	0	0	0	117.5
306	F	36.8	Very low	40.4	Very low	183 Å²	183	143 Å²	143	80%	0.803	73%	0.725	S	S	*	*			trans	-82.9	127.4	167.8	-158	-96.7	0	0	0	110.8
307	N	40.8	Very low	41.1	Very low	109 Å²	109	143.7 Å²	143.7	58%	0.583	72%	0.719	S	S	*	*			trans	-116.3	109.9	-178.1	-176.5	-8.4	0	0	0	110.5	R309	N307-R309 VanDerWaalsContact C-N 3.32Å; N307-R309 PolarHBondContact O-N 3.47Å
308	P	42.4	Very low	40.5	Very low	92 Å²	92	142.6 Å²	142.6	60%	0.597	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-18.1	-166.2	26.5	-34.7	0	0	0	115.2	A310 V311	P308-A310 VanDerWaalsContact C-N 3.27Å; P308-A310 PolarHBondContact O-N 3.33Å; P308-V311 PolarHBondContact O-N 3.4Å
309	R	41.2	Very low	41.2	Very low	205 Å²	205	143.6 Å²	143.6	77%	0.774	71%	0.705	S	S	*	*	H	α-helix	trans	-65.2	-25.9	-176.5	-77.8	-173.6	169.6	-175.7	-3.6	114.3	N307 V311 T312	N307-R309 VanDerWaalsContact C-N 3.32Å; N307-R309 PolarHBondContact O-N 3.47Å; R309-V311 PolarHBondContact O-N 3.35Å; R309-T312 PolarHBondContact O-OG1 3.41Å
310	A	47.2	Very low	41.2	Very low	64 Å²	64	136.4 Å²	136.4	53%	0.529	70%	0.701	S	S	.	*	H	α-helix	trans	-71.2	-15.9	179.4	0	0	0	0	0	114.1	P308	P308-A310 VanDerWaalsContact C-N 3.27Å; P308-A310 PolarHBondContact O-N 3.33Å
311	V	46	Very low	40.8	Very low	80 Å²	80	134 Å²	134	49%	0.485	70%	0.703	S	S	.	*	H	α-helix	trans	-85.7	-41.5	178.8	-177	0	0	0	0	111	P308 R309 E313 R314	P308-V311 PolarHBondContact O-N 3.4Å; R309-V311 PolarHBondContact O-N 3.35Å; V311-E313 VanDerWaalsContact C-N 3.26Å; V311-E313 PolarHBondContact O-N 3.36Å; V311-R314 PolarHBondContact O-N 3.15Å
312	T	44.2	Very low	40.9	Very low	96 Å²	96	127.5 Å²	127.5	59%	0.589	70%	0.697	S	S	*	*	H	α-helix	trans	-60.7	-34	176.6	35.1	0	0	0	0	113.1	R309 I315 A316	R309-T312 PolarHBondContact O-OG1 3.41Å; T312-I315 PolarHBondContact O-N 3.39Å; T312-A316 PolarHBondContact O-N 3Å
313	E	42.6	Very low	40.7	Very low	134 Å²	134	124.4 Å²	124.4	63%	0.626	70%	0.699	S	S	*	*	H	α-helix	trans	-72.5	-32.1	-176.3	-159.9	160.9	-132.7	0	0	112.9	V311 Q317	V311-E313 VanDerWaalsContact C-N 3.26Å; V311-E313 PolarHBondContact O-N 3.36Å; E313-Q317 WeakPolarHBondContact O-CG 3.1Å; E313-Q317 PolarHBondContact O-N 3.45Å
314	R	43.2	Very low	40.3	Very low	194 Å²	194	130.1 Å²	130.1	73%	0.732	70%	0.704	S	S	*	*	H	α-helix	trans	-71.2	-30.3	172.8	-84.2	-174.9	169.8	174.7	-2.3	113.7	V311 Q317	V311-R314 PolarHBondContact O-N 3.15Å; R314-Q317 PolarHBondContact O-N 3.13Å
315	I	45.4	Very low	40.1	Very low	119 Å²	119	133.1 Å²	133.1	61%	0.61	71%	0.71	S	S	*	*	H	α-helix	trans	-74	-37.7	176.9	-61.6	173.7	0	0	0	109.7	T312 Q317 T318	T312-I315 PolarHBondContact O-N 3.39Å; I315-Q317 VanDerWaalsContact C-N 3.25Å; I315-Q317 PolarHBondContact O-N 2.99Å; I315-T318 PolarHBondContact O-N 3.32Å; I315-T318 PolarHBondContact O-OG1 3.4Å
316	A	44.3	Very low	39.5	Very low	72 Å²	72	132.4 Å²	132.4	60%	0.595	71%	0.706	S	S	*	*	H	α-helix	trans	-64.1	-24.5	173.3	0	0	0	0	0	114.2	T312	T312-A316 PolarHBondContact O-N 3Å
317	Q	43.9	Very low	39.1	Very low	149 Å²	149	130 Å²	130	70%	0.696	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-11.6	179.4	-77.4	175.3	-3.5	0	0	114.7	E313 R314 I315	E313-Q317 WeakPolarHBondContact O-CG 3.1Å; E313-Q317 PolarHBondContact O-N 3.45Å; R314-Q317 PolarHBondContact O-N 3.13Å; I315-Q317 VanDerWaalsContact C-N 3.25Å; I315-Q317 PolarHBondContact O-N 2.99Å
318	T	44.9	Very low	38.5	Very low	93 Å²	93	133.9 Å²	133.9	57%	0.571	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-20.8	-178.3	54.2	0	0	0	0	114.6	I315	I315-T318 PolarHBondContact O-N 3.32Å; I315-T318 PolarHBondContact O-OG1 3.4Å
319	Y	42.3	Very low	38	Very low	210 Å²	210	134 Å²	134	82%	0.824	72%	0.716	S	S	*	*	S	Bend	trans	-139.5	72.3	-179.2	-69.6	-77.1	0	0	0	111.9
320	G	33.7	Very low	37.5	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	72%	0.717	S	S	*	*			trans	-85.3	160	169.4	0	0	0	0	0	113.2
321	T	37.3	Very low	36.8	Very low	148 Å²	148	132.2 Å²	132.2	91%	0.908	73%	0.726	S	S	*	*			trans	-117.5	151.5	-164.2	52.4	0	0	0	0	115.5
322	G	30.1	Very low	36.1	Very low	79 Å²	79	133.7 Å²	133.7	81%	0.814	74%	0.74	S	S	*	*			trans	122.7	151.4	165.9	0	0	0	0	0	113.6
323	S	31.5	Very low	35.4	Very low	127 Å²	127	134.7 Å²	134.7	89%	0.888	75%	0.746	S	S	*	*			cis	-153.8	-170.7	-5.3	-164.7	0	0	0	0	110.8
324	R	35.8	Very low	34.8	Very low	233 Å²	233	135 Å²	135	88%	0.879	76%	0.756	S	S	*	*			trans	-82.4	169.8	-171.6	-68.5	-180	169.2	-171.9	-3.3	115.4
325	Q	30.2	Very low	34.1	Very low	182 Å²	182	132.9 Å²	132.9	85%	0.85	76%	0.759	S	S	*	*			trans	94.9	148.7	167.4	-60.7	-164.6	33.3	0	0	116.2
326	L	26.1	Very low	34.1	Very low	137 Å²	137	133.2 Å²	133.2	72%	0.717	77%	0.769	S	S	*	*			cis	-169.8	163	-23.5	-171.1	70.6	0	0	0	108.6
327	L	27.7	Very low	33.6	Very low	133 Å²	133	133.6 Å²	133.6	70%	0.696	77%	0.772	S	S	*	*			trans	77.8	119	169.6	-52.9	-178.9	0	0	0	116.2
328	K	28.7	Very low	33.6	Very low	190 Å²	190	132 Å²	132	83%	0.826	77%	0.774	S	S	*	*				68.8	140.7	95	-71.4	-171.3	177.6	-178.6	0	114.7
329	S	31.6	Very low	33.7	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	79%	0.788	S	S	*	*			cis	-165.1	150.6	-5.9	42.4	0	0	0	0	107.6
330	T	31.5	Very low	33.3	Very low	128 Å²	128	128.3 Å²	128.3	79%	0.785	79%	0.786	S	S	*	*				-177.4	166.1	70.8	37.7	0	0	0	0	109.1
331	S	32.2	Very low	33.3	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	79%	0.793	S	S	*	*			cis	-177.4	170.6	-16.7	54	0	0	0	0	109.2
332	S	30.4	Very low	33	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	79%	0.79	S	S	*	*			trans	71	142.3	173.6	-106.6	0	0	0	0	116.7
333	T	29.4	Very low	33.2	Very low	117 Å²	117	133.5 Å²	133.5	72%	0.718	79%	0.789	S	S	*	*			cis	-163.7	144.2	-14.9	-108.8	0	0	0	0	111.8
334	V	31	Very low	33.2	Very low	140 Å²	140	139 Å²	139	85%	0.848	79%	0.791	S	S	*	*			trans	73.1	157.6	163	159.8	0	0	0	0	120.3
335	L	29.3	Very low	33.1	Very low	150 Å²	150	132.8 Å²	132.8	79%	0.785	78%	0.783	S	S	*	*			trans	-110.1	177.7	-163.6	-91.7	171	0	0	0	110.6
336	P	44.5	Very low	33.3	Very low	127 Å²	127	130.3 Å²	130.3	83%	0.825	78%	0.78	S	S	*	*			cis	-137.1	-176.5	30.4	40.4	-19.4	0	0	0	118
337	A	33.8	Very low	33.7	Very low	79 Å²	79	129.2 Å²	129.2	65%	0.653	78%	0.784	S	S	*	*			trans	-112.9	162.9	-168.1	0	0	0	0	0	113
338	P	43.9	Very low	33.8	Very low	115 Å²	115	126.1 Å²	126.1	75%	0.747	78%	0.784	S	S	*	*			trans	-77.3	156.6	171.6	33.3	-36.5	0	0	0	112.6
339	P	47	Very low	33.9	Very low	132 Å²	132	125.5 Å²	125.5	86%	0.857	78%	0.784	S	S	*	*			trans	-74.3	150.5	165.8	32.8	-33.9	0	0	0	111
340	A	34.5	Very low	34	Very low	95 Å²	95	126.3 Å²	126.3	79%	0.785	79%	0.785	S	S	*	*			trans	-124.8	162.4	-176.2	0	0	0	0	0	113.2
341	L	32.8	Very low	33.8	Very low	174 Å²	174	129.1 Å²	129.1	91%	0.911	78%	0.783	S	S	*	*			trans	-26.7	137.2	172.4	-55.3	169.4	0	0	0	116.3
342	V	30.2	Very low	33.7	Very low	139 Å²	139	133.6 Å²	133.6	84%	0.842	79%	0.785	S	S	*	*			trans	-124.3	124.2	150.5	178.3	0	0	0	0	108.1
343	A	35.3	Very low	33.8	Very low	96 Å²	96	133.2 Å²	133.2	79%	0.793	78%	0.782	S	S	*	*			trans	-104.2	133.5	171.5	0	0	0	0	0	109.7
344	R	31.6	Very low	34	Very low	244 Å²	244	132 Å²	132	92%	0.921	78%	0.784	S	S	*	*			trans	-155.6	135	165.7	-132.4	169.9	177.4	171.8	-3.1	110.9
345	S	33.6	Very low	34.2	Very low	102 Å²	102	130.7 Å²	130.7	71%	0.713	78%	0.777	S	S	*	*			trans	-95.2	150.3	173.4	45.4	0	0	0	0	110.6
346	T	34.6	Very low	34.3	Very low	130 Å²	130	132.5 Å²	132.5	80%	0.798	78%	0.781	S	S	*	*			trans	169	138.6	132.6	30.6	0	0	0	0	112.9
347	S	33.8	Very low	33.7	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	78%	0.777	S	S	*	*			trans	31	138.5	146.8	61.2	0	0	0	0	124
348	G	30	Very low	33.7	Very low	69 Å²	69	134.7 Å²	134.7	71%	0.711	79%	0.786	S	S	*	*			trans	87.1	160.4	154.3	0	0	0	0	0	115.2
349	E	32	Very low	33.1	Very low	177 Å²	177	136.4 Å²	136.4	83%	0.827	79%	0.789	S	S	*	*			cis	176.2	141.2	-25.2	-121.4	179.6	157.5	0	0	105.1
350	T	32.1	Very low	32.6	Very low	112 Å²	112	135.7 Å²	135.7	69%	0.687	79%	0.787	S	S	*	*			trans	58.1	124.4	155.2	58	0	0	0	0	123.4
351	Y	28.7	Very low	32.6	Very low	188 Å²	188	138.8 Å²	138.8	74%	0.737	79%	0.789	S	S	*	*				100.8	135.6	119.6	-88.3	-148.7	0	0	0	123.1
352	Y	29.3	Very low	32.6	Very low	196 Å²	196	138 Å²	138	77%	0.769	79%	0.785	S	S	*	*			trans	48.5	139.6	169	-64.6	-75.3	0	0	0	118.6
353	S	32.8	Very low	32.6	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	78%	0.783	S	S	*	*			cis	118.6	155.1	7.9	-74.8	0	0	0	0	111.2
354	A	32.4	Very low	32.4	Very low	91 Å²	91	136.2 Å²	136.2	75%	0.752	78%	0.778	S	S	*	*			trans	70.4	148.4	170.1	0	0	0	0	0	115.9
355	T	35.2	Very low	33.2	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	77%	0.772	S	S	*	*			cis	-159.8	142.9	-10.2	13.7	0	0	0	0	110.4
356	E	32.6	Very low	34.2	Very low	188 Å²	188	131.1 Å²	131.1	88%	0.879	77%	0.774	S	S	*	*			trans	43.4	144.3	132.4	-64.5	161.5	-163.5	0	0	124.1
357	G	32.4	Very low	34.9	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	78%	0.776	S	S	*	*			trans	93.4	148.3	159	0	0	0	0	0	117.5
358	E	33.2	Very low	34.9	Very low	181 Å²	181	135 Å²	135	85%	0.846	78%	0.782	S	S	*	*			cis	-167.6	176.6	-33.2	-129.2	171.3	-175.9	0	0	109.5
359	D	30.5	Very low	35.2	Very low	151 Å²	151	137.6 Å²	137.6	81%	0.807	79%	0.789	S	S	*	*			trans	71	162.8	160.4	-73.2	-15.6	0	0	0	123.4
360	S	37.3	Very low	35.2	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	79%	0.787	S	S	*	*			trans	-152.4	141.2	-167.3	-67.2	0	0	0	0	113
361	I	33.7	Very low	35.3	Very low	160 Å²	160	138.2 Å²	138.2	82%	0.821	79%	0.793	S	S	*	*			trans	-144	116.8	177	-57.3	-177	0	0	0	107.1
362	L	33.3	Very low	35.4	Very low	158 Å²	158	134.6 Å²	134.6	83%	0.827	79%	0.79	S	S	*	*				55.6	142.1	92.1	-100.2	74	0	0	0	115.1
363	S	29.5	Very low	35.7	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	79%	0.79	S	S	*	*			cis	-158.2	-179.8	1.4	-161.5	0	0	0	0	111.7
364	A	31.9	Very low	35.4	Very low	84 Å²	84	133.2 Å²	133.2	69%	0.694	80%	0.796	S	S	*	*			trans	-88.7	177.4	177.6	0	0	0	0	0	113.1
365	P	47.7	Very low	35.5	Very low	123 Å²	123	136.6 Å²	136.6	80%	0.799	80%	0.799	S	S	*	*				-150.1	177	71.1	39.8	-19.4	0	0	0	117.2
366	P	54.4	Low	35.9	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	80%	0.8	S	S	*	*			trans	-107.6	177.1	175.9	41.3	-34.8	0	0	0	114.5
367	P	49.8	Very low	35.8	Very low	130 Å²	130	136.1 Å²	136.1	84%	0.844	80%	0.796	S	S	*	*			trans	-136.5	169.8	138.3	38.9	-27.3	0	0	0	114.8
368	Q	34.1	Very low	36	Very low	195 Å²	195	139.8 Å²	139.8	91%	0.911	79%	0.794	S	S	*	*			trans	-115.4	151.8	177.5	-60.1	171.5	-12.2	0	0	111.4
369	S	35.7	Very low	35.8	Very low	124 Å²	124	138.1 Å²	138.1	87%	0.867	79%	0.791	S	S	*	*			trans	-165.1	173.2	152	60.5	0	0	0	0	111.4
370	T	33.2	Very low	36	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	79%	0.788	S	S	*	*			trans	-128.8	160.9	-157.1	46.9	0	0	0	0	115.5
371	E	34.3	Very low	35.8	Very low	174 Å²	174	137.7 Å²	137.7	81%	0.813	78%	0.779	S	S	*	*			trans	86.7	138.3	144.7	-90.2	-179.2	-147	0	0	124.5
372	V	30.5	Very low	35.7	Very low	112 Å²	112	138 Å²	138	68%	0.679	78%	0.777	S	S	*	*			trans	76.6	106.4	143.2	176.8	0	0	0	0	122.5
373	I	34.4	Very low	35.7	Very low	150 Å²	150	141 Å²	141	77%	0.769	78%	0.777	S	S	*	*			trans	35.9	125.2	130.7	-48.8	170.9	0	0	0	120.5
374	S	27.2	Very low	35.7	Very low	119 Å²	119	141.6 Å²	141.6	83%	0.832	77%	0.771	S	S	*	*			trans	-169.1	157.4	136	-87.5	0	0	0	0	114.5
375	I	35.8	Very low	35.7	Very low	162 Å²	162	145 Å²	145	83%	0.831	78%	0.778	S	S	*	*			trans	-124.2	144.3	174.7	-55.7	167.9	0	0	0	108.9
376	P	41.8	Very low	35	Very low	109 Å²	109	142 Å²	142	71%	0.708	77%	0.769	S	S	*	*			trans	-144.8	132.7	144.3	34.8	-18.1	0	0	0	116.5
377	K	31.8	Very low	33.9	Very low	183 Å²	183	146 Å²	146	80%	0.796	78%	0.775	S	S	*	*			trans	53.3	161	130.2	-65.5	-169.2	174.2	-174.1	0	122.7
378	Q	35.5	Very low	32.8	Very low	149 Å²	149	147.6 Å²	147.6	70%	0.696	77%	0.773	S	S	*	*			cis	-172.8	-170.9	-28.6	-170.2	157.6	-5	0	0	107.7
379	D	29.8	Very low	32.6	Very low	146 Å²	146	144.5 Å²	144.5	78%	0.781	77%	0.767	S	S	*	*			trans	98.3	140	158.4	-53.8	-9.3	0	0	0	117.9
380	D	33.8	Very low	33.2	Very low	141 Å²	141	143.6 Å²	143.6	75%	0.754	76%	0.758	S	S	*	*			cis	-165.5	172.8	-25.2	-163.1	11.5	0	0	0	112.1
381	L	33.8	Very low	33	Very low	117 Å²	117	145.5 Å²	145.5	61%	0.613	76%	0.763	S	S	*	*			trans	89.6	112.4	155.6	-56.8	-178.3	0	0	0	124.4
382	Q	32.1	Very low	32.7	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	75%	0.752	S	S	*	*				71.9	156.1	128.5	-64.7	170.3	-33	0	0	123.3
383	R	32.7	Very low	32.8	Very low	219 Å²	219	145.2 Å²	145.2	83%	0.826	76%	0.758	S	S	*	*			cis	-167.2	172.2	-49.2	-132.9	-170.3	-163.2	-163.7	7.1	112.5
384	D	29.1	Very low	32.6	Very low	126 Å²	126	147 Å²	147	67%	0.674	76%	0.76	S	S	*	*			trans	68.6	128.7	167.6	-50.4	-16.3	0	0	0	116.5
385	D	33.1	Very low	32.8	Very low	156 Å²	156	149.3 Å²	149.3	83%	0.834	76%	0.758	S	S	*	*			cis	83.2	125	35	-74.7	-50.3	0	0	0	115.7
386	G	31.6	Very low	32.4	Very low	60 Å²	60	149.6 Å²	149.6	62%	0.619	76%	0.758	S	S	*	*			cis	166.6	169	-10.2	0	0	0	0	0	115.3
387	K	31.4	Very low	31.9	Very low	200 Å²	200	149.3 Å²	149.3	87%	0.87	76%	0.758	S	S	*	*			trans	68.5	146.7	166.3	-59.1	167.9	-176.9	165.3	0	116.4
388	M	26.5	Very low	31.9	Very low	163 Å²	163	148.6 Å²	148.6	80%	0.803	76%	0.761	S	S	*	*			cis	-158.3	135.7	48.6	-86.5	-174.3	66	0	0	115.6
389	V	29.7	Very low	31.6	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	76%	0.755	S	S	*	*				57.3	142.2	118.6	177.7	0	0	0	0	120.6
390	P	48.9	Very low	32.2	Very low	105 Å²	105	148.1 Å²	148.1	68%	0.682	76%	0.757	S	S	*	*			trans	-121	-175.9	-135	45.3	-37.2	0	0	0	116.6
391	L	28.6	Very low	32.3	Very low	167 Å²	167	146.9 Å²	146.9	87%	0.874	75%	0.745	S	S	*	*			trans	-179.4	158	152	-112.3	105.8	0	0	0	109.7
392	V	29.6	Very low	32.3	Very low	97 Å²	97	147.3 Å²	147.3	59%	0.588	75%	0.747	S	S	*	*			cis	-168.4	144	-37.1	92.7	0	0	0	0	111.8
393	K	30.9	Very low	32.6	Very low	183 Å²	183	146.9 Å²	146.9	80%	0.796	75%	0.747	S	S	*	*			trans	67	158.7	165.8	-62.2	163.6	-163.4	163.6	0	116.3
394	K	30.9	Very low	32.7	Very low	188 Å²	188	144.1 Å²	144.1	82%	0.817	74%	0.743	S	S	*	*			cis	-155.4	124.2	4.4	-140.1	178.2	-179.2	-173.9	0	114.7
395	Q	30.6	Very low	33	Very low	168 Å²	168	144.9 Å²	144.9	79%	0.785	75%	0.748	S	S	*	*			trans	-14.2	155.3	132.2	-97.4	168.3	-18.8	0	0	118.5
396	M	27.8	Very low	33.4	Very low	168 Å²	168	145.8 Å²	145.8	83%	0.828	75%	0.753	S	S	*	*			cis	-151.9	-176.2	21.6	-60.1	-168.6	80.6	0	0	115.4
397	S	31.8	Very low	33.7	Very low	102 Å²	102	151.9 Å²	151.9	71%	0.713	77%	0.765	S	S	*	*			trans	-84	-177.7	-179.5	54.8	0	0	0	0	118
398	I	31.3	Very low	34	Very low	169 Å²	169	148 Å²	148	87%	0.867	75%	0.753	S	S	*	*			trans	-154.1	156.9	159.1	-106.2	159.2	0	0	0	112.4
399	D	30.7	Very low	34.7	Very low	106 Å²	106	149.9 Å²	149.9	57%	0.567	76%	0.76	S	S	*	*			trans	-80.5	168.3	-171.4	-72.8	-10.5	0	0	0	117.7	S171	S171-D399 WeakPolarHBondContact CB-OD2 3.15Å; S171-D399 PolarHBondContact OG-OD2 2.77Å
400	E	41.1	Very low	34.9	Very low	178 Å²	178	147.1 Å²	147.1	83%	0.832	76%	0.758	S	S	*	*			trans	-79.5	170.4	162.6	-54.6	-175.2	119.9	0	0	114.8
401	K	35.4	Very low	34	Very low	115 Å²	115	152.2 Å²	152.2	50%	0.5	77%	0.769	S	S	.	*			trans	-172.4	120.1	138.1	-109.5	-168.8	177.1	-168.2	0	116.2	G170	G170-K401 WeakPolarHBondContact O-CD 3.39Å; G170-K401 WeakPolarHBondContact O-CE 3.3Å; G170-K401 PolarHBondContact O-NZ 3.3Å
402	I	35.1	Very low	34.2	Very low	127 Å²	127	147.6 Å²	147.6	65%	0.651	76%	0.762	S	S	*	*			trans	66	124	132.6	-67.9	171.9	0	0	0	121.4
403	M	38.2	Very low	34.3	Very low	158 Å²	158	150 Å²	150	78%	0.778	77%	0.772	S	S	*	*			trans	61	155.1	155.2	-71.5	158.6	59.7	0	0	117.3
404	E	34.1	Very low	34.8	Very low	161 Å²	161	145.6 Å²	145.6	75%	0.752	76%	0.764	S	S	*	*			cis	-154.5	-164.5	36.6	-137.8	143.7	-124	0	0	111.1
405	D	35.8	Very low	34.8	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	76%	0.758	S	S	*	*			trans	-71.4	166.2	-170.2	-42.7	-80.2	0	0	0	116.9
406	D	42	Very low	35	Very low	175 Å²	175	143.3 Å²	143.3	94%	0.936	76%	0.755	S	S	*	*			trans	-149.1	142.2	159	-98	-41.3	0	0	0	110.2
407	E	37.9	Very low	35.4	Very low	188 Å²	188	142.6 Å²	142.6	88%	0.879	76%	0.76	S	S	*	*			trans	-110.2	-179.5	-165.7	-65.9	-168.4	117.7	0	0	115.8	E409	E407-E409 PolarHBondContact O-N 3.32Å
408	D	36.8	Very low	35.6	Very low	117 Å²	117	145.5 Å²	145.5	63%	0.626	77%	0.767	S	S	*	*			trans	-57.5	110.1	175.2	-76.1	-36	0	0	0	112.5	G410 R655	D408-G410 PolarHBondContact O-N 3.1Å; D408-R655 VanDerWaalsContact CG-NH2 3.33Å; D408-R655 IonicContact OD1-CZ 2.75Å; D408-R655 IonicContact OD1-NH2 3.53Å; D408-R655 PolarHBondContact OD1-NH2 3.49Å; D408-R655 IonicContact OD2-CZ 2.58Å; D408-R655 VanDerWaalsContact OD2-CZ 3.26Å; D408-R655 IonicContact OD2-NH1 2.77Å; D408-R655 PolarHBondContact OD2-NH1 2.88Å; D408-R655 IonicContact OD2-NH2 3.08Å; D408-R655 PolarHBondContact OD2-NH2 2.93Å
409	E	41.3	Very low	35.8	Very low	204 Å²	204	147.5 Å²	147.5	95%	0.953	77%	0.769	S	S	*	*			trans	-73.3	98.4	167.6	-82.3	-154.9	145.4	0	0	111.8	E407	E407-E409 PolarHBondContact O-N 3.32Å
410	G	33.7	Very low	36	Very low	70 Å²	70	154.4 Å²	154.4	72%	0.722	79%	0.787	S	S	*	*			trans	-71.4	148.1	173.8	0	0	0	0	0	114.3	D408 G412	D408-G410 PolarHBondContact O-N 3.1Å; G410-G412 PolarHBondContact O-N 3.39Å; G410-G412 VanDerWaalsContact O-N 3.11Å
411	F	31.2	Very low	35.4	Very low	212 Å²	212	149.4 Å²	149.4	93%	0.93	78%	0.783	S	S	*	*			trans	-72.8	99.7	-179.6	-165	-91.5	0	0	0	111.2
412	G	32.5	Very low	35.4	Very low	70 Å²	70	153.5 Å²	153.5	72%	0.722	80%	0.804	S	S	*	*			trans	-77.7	139.8	-177.5	0	0	0	0	0	114.4	G410	G410-G412 PolarHBondContact O-N 3.39Å; G410-G412 VanDerWaalsContact O-N 3.11Å
413	D	31.3	Very low	35.2	Very low	148 Å²	148	150.5 Å²	150.5	79%	0.791	81%	0.805	S	S	*	*			trans	-113.7	178	168.6	-146	-30.8	0	0	0	111.8
414	S	41.8	Very low	35.1	Very low	90 Å²	90	148.5 Å²	148.5	63%	0.629	81%	0.806	S	S	*	*			trans	-56.8	155.4	-173.2	-60	0	0	0	0	113.9
415	M	31.3	Very low	35.1	Very low	140 Å²	140	146 Å²	146	69%	0.69	81%	0.806	S	S	*	*			cis	-167.1	166.1	20.9	-140.1	-171.7	-44.2	0	0	112.4
416	K	34	Very low	35	Very low	169 Å²	169	147.4 Å²	147.4	74%	0.735	81%	0.813	S	S	*	*			trans	57.5	118	153	-70.4	159.3	177.4	159.6	0	119.4
417	T	37.2	Very low	34.5	Very low	152 Å²	152	143.2 Å²	143.2	93%	0.933	80%	0.803	S	S	*	*				-155	159.8	117.3	6.7	0	0	0	0	111.4
418	I	35.9	Very low	34.2	Very low	164 Å²	164	145.4 Å²	145.4	84%	0.841	80%	0.803	S	S	*	*			trans	-93.7	140.4	-167.3	-63.9	160.4	0	0	0	110.7
419	K	34.3	Very low	34.3	Very low	211 Å²	211	144.2 Å²	144.2	92%	0.917	80%	0.804	S	S	*	*			trans	-119.6	115.1	161	-87.2	-175.6	176.5	174.2	0	111.1
420	R	34.6	Very low	33.9	Very low	251 Å²	251	142 Å²	142	95%	0.947	80%	0.798	S	S	*	*			trans	-151.5	129.3	156.3	-141.1	179	-169.8	-170.2	2.9	109.1
421	G	29.8	Very low	34	Very low	73 Å²	73	143.1 Å²	143.1	75%	0.753	80%	0.795	S	S	*	*			trans	-154.3	117.8	174.5	0	0	0	0	0	109.7
422	Q	35.8	Very low	34.1	Very low	200 Å²	200	140.5 Å²	140.5	94%	0.935	79%	0.79	S	S	*	*			trans	-171	136	174.8	-114.6	177.7	-5.2	0	0	109.3
423	G	30.5	Very low	34.2	Very low	65 Å²	65	145.6 Å²	145.6	67%	0.67	79%	0.792	S	S	*	*			trans	71.6	124.2	170.3	0	0	0	0	0	115.8
424	S	34.7	Very low	34.1	Very low	116 Å²	116	145.1 Å²	145.1	81%	0.811	79%	0.789	S	S	*	*				71.3	129.5	59.2	74.6	0	0	0	0	113.6
425	S	35.4	Very low	33.7	Very low	107 Å²	107	146 Å²	146	75%	0.748	80%	0.795	S	S	*	*			cis	179.6	151.1	-2.1	45.2	0	0	0	0	110.5
426	L	34.1	Very low	35.2	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	80%	0.801	S	S	*	*			trans	-173	143.2	142.9	-109.2	166.8	0	0	0	113.7
427	A	31.2	Very low	35	Very low	88 Å²	88	147 Å²	147	73%	0.727	81%	0.808	S	S	*	*			trans	61.4	147.8	160.4	0	0	0	0	0	120.8
428	R	31.2	Very low	34.7	Very low	233 Å²	233	145.4 Å²	145.4	88%	0.879	80%	0.798	S	S	*	*			cis	-161.9	100.6	-37.5	-131.3	179	-172	169.4	2.3	111.6
429	S	37.8	Very low	34.5	Very low	93 Å²	93	143.2 Å²	143.2	65%	0.65	79%	0.788	S	S	*	*			trans	40.6	146	141.3	63.1	0	0	0	0	124.9
430	L	33.8	Very low	34.3	Very low	158 Å²	158	139.8 Å²	139.8	83%	0.827	78%	0.775	S	S	*	*			trans	90	138.5	157.9	-46.8	-173.4	0	0	0	117.2
431	S	36.3	Very low	34.2	Very low	93 Å²	93	136 Å²	136	65%	0.65	77%	0.769	S	S	*	*			cis	-168.1	165.5	-11.3	-104.1	0	0	0	0	113.3
432	L	33.1	Very low	34.1	Very low	157 Å²	157	141.6 Å²	141.6	82%	0.822	77%	0.772	S	S	*	*			trans	76.7	157.7	167.8	-50.7	-178.5	0	0	0	119.1
433	K	33.9	Very low	34.8	Very low	176 Å²	176	136.3 Å²	136.3	77%	0.765	76%	0.755	S	S	*	*			cis	-169.1	158.9	-49.3	-140.5	-179.1	-179.5	179.3	0	111.7
434	L	29.5	Very low	34.8	Very low	139 Å²	139	141 Å²	141	73%	0.728	76%	0.763	S	S	*	*			trans	82	103	154.9	-61.9	170.1	0	0	0	123.3
435	S	32.3	Very low	34.5	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	75%	0.754	S	S	*	*				66.3	152.4	110.5	-55.1	0	0	0	0	125.2
436	P	64.5	Low	34.4	Very low	124 Å²	124	137.6 Å²	137.6	81%	0.805	75%	0.754	S	S	*	*			trans	-111.5	-175.3	-175.1	44.3	-36.4	0	0	0	115.3
437	K	28.1	Very low	34.1	Very low	205 Å²	205	136 Å²	136	89%	0.891	75%	0.747	S	S	*	*			trans	-154.5	170.1	164.7	-120.9	177.8	-176.3	-175.8	0	116.3
438	T	31.6	Very low	34.2	Very low	118 Å²	118	137.4 Å²	137.4	72%	0.724	75%	0.746	S	S	*	*			trans	-91.6	-165.8	-170.4	50.3	0	0	0	0	112.5
439	D	31.5	Very low	34.2	Very low	118 Å²	118	132.7 Å²	132.7	63%	0.631	73%	0.734	S	S	*	*			cis	-173.1	154.9	23.6	-141.6	6.1	0	0	0	115.5
440	Q	31.2	Very low	34	Very low	139 Å²	139	135.6 Å²	135.6	65%	0.65	74%	0.735	S	S	*	*			trans	58.4	170.7	154	-30.9	-147.7	25.1	0	0	120.9
441	Q	32.1	Very low	33.8	Very low	172 Å²	172	133.1 Å²	133.1	80%	0.804	73%	0.731	S	S	*	*			cis	-149.5	-172.3	0.1	-145.2	165.1	53.5	0	0	113.8
442	K	28.4	Very low	33.3	Very low	190 Å²	190	134 Å²	134	83%	0.826	74%	0.736	S	S	*	*			trans	-95.7	-163.5	-175.7	-136.6	-175.6	172.2	-173.6	0	109.6
443	P	48.5	Very low	33.1	Very low	89 Å²	89	131.5 Å²	131.5	58%	0.578	73%	0.732	S	S	*	*			cis	-143.6	-177.8	-12.9	43.3	-24.3	0	0	0	117.9
444	I	30.4	Very low	32.9	Very low	165 Å²	165	130 Å²	130	85%	0.846	74%	0.737	S	S	*	*			trans	62.8	141.4	147.7	-72.6	154.9	0	0	0	118.5
445	G	30.1	Very low	33.3	Very low	60 Å²	60	128.5 Å²	128.5	62%	0.619	74%	0.736	S	S	*	*			cis	143	164.9	-3.4	0	0	0	0	0	112.5
446	A	31.7	Very low	33.1	Very low	90 Å²	90	128.4 Å²	128.4	74%	0.744	74%	0.735	S	S	*	*			trans	66.4	157.1	171.8	0	0	0	0	0	117
447	D	29.6	Very low	31.7	Very low	140 Å²	140	130.2 Å²	130.2	75%	0.749	74%	0.737	S	S	*	*			cis	-168.1	151.8	-25.6	-101.3	-28	0	0	0	109.7
448	T	32.7	Very low	32.7	Very low	118 Å²	118	125.9 Å²	125.9	72%	0.724	73%	0.73	S	S	*	*			trans	63.4	158.9	152.4	61.8	0	0	0	0	118.6
449	E	30.6	Very low	32.8	Very low	133 Å²	133	126.1 Å²	126.1	62%	0.621	73%	0.731	S	S	*	*			cis	-166.3	168.5	-18.3	-112.6	177.8	158.4	0	0	111.8
450	K	33	Very low	32.9	Very low	155 Å²	155	124.1 Å²	124.1	67%	0.674	73%	0.731	S	S	*	*			trans	60.5	111	142.7	-74.3	163.2	-172.8	152.1	0	121.5
451	S	30.5	Very low	33.7	Very low	105 Å²	105	123.6 Å²	123.6	73%	0.734	74%	0.74	S	S	*	*				51.9	146.1	123.8	63.5	0	0	0	0	121.6
452	C	25.9	Very low	33.9	Very low	111 Å²	111	122.5 Å²	122.5	75%	0.75	74%	0.739	S	S	*	*			cis	-163.7	166.2	7.6	-125.7	0	0	0	0	112.4
453	S	28.8	Very low	34	Very low	106 Å²	106	121 Å²	121	74%	0.741	74%	0.739	S	S	*	*			trans	51	111.5	150.7	-54.2	0	0	0	0	120.8
454	T	30.3	Very low	33.3	Very low	144 Å²	144	121.8 Å²	121.8	88%	0.883	75%	0.747	S	S	*	*			trans	-162.8	158.9	146.3	6.4	0	0	0	0	110.1
455	P	37.3	Very low	33.8	Very low	107 Å²	107	123.2 Å²	123.2	70%	0.695	74%	0.742	S	S	*	*			trans	-113.4	168.3	-158.9	42	-35.5	0	0	0	116.4
456	S	27.6	Very low	34.1	Very low	107 Å²	107	127.2 Å²	127.2	75%	0.748	74%	0.744	S	S	*	*			trans	48	120.5	143.4	63.5	0	0	0	0	122.2
457	L	35.3	Very low	34	Very low	162 Å²	162	125.5 Å²	125.5	85%	0.848	74%	0.735	S	S	*	*			trans	-25.9	155.3	135.4	-70.9	164.4	0	0	0	114.3
458	P	49.3	Very low	34.3	Very low	114 Å²	114	124 Å²	124	74%	0.74	74%	0.736	S	S	*	*			cis	-152.5	-164.4	45.5	39.4	-16.4	0	0	0	116.1
459	T	33.8	Very low	34.4	Very low	123 Å²	123	124.8 Å²	124.8	76%	0.755	74%	0.741	S	S	*	*				144	140.1	128.3	-57.8	0	0	0	0	113.6
460	A	34.5	Very low	34.5	Very low	76 Å²	76	123.6 Å²	123.6	63%	0.628	75%	0.747	S	S	*	*			trans	-120.8	-178.1	169	0	0	0	0	0	109.9
461	P	46.5	Very low	34.4	Very low	129 Å²	129	122 Å²	122	84%	0.838	76%	0.756	S	S	*	*			trans	-131.4	155.3	163.9	38	-25.4	0	0	0	116.1
462	L	37	Very low	34.4	Very low	148 Å²	148	124.8 Å²	124.8	78%	0.775	76%	0.761	S	S	*	*			cis	-174.7	-177.9	-42.8	-117.9	172.9	0	0	0	110.9
463	L	31.2	Very low	34.6	Very low	159 Å²	159	131.1 Å²	131.1	83%	0.832	77%	0.769	S	S	*	*			trans	86	128.4	173.6	-50	173.2	0	0	0	114.1
464	S	33.3	Very low	34.8	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	78%	0.776	S	S	*	*			cis	-169.9	-172.8	-1	62.4	0	0	0	0	108.4
465	R	40.2	Very low	34.4	Very low	196 Å²	196	138.2 Å²	138.2	74%	0.74	78%	0.775	S	S	*	*			cis	-178.5	150.1	-37.5	-84.9	165.3	100.6	-71.6	-12	103.8
466	Q	37.2	Very low	34	Very low	143 Å²	143	139.6 Å²	139.6	67%	0.668	78%	0.781	S	S	*	*			cis	-156.3	178.1	5.9	-121.7	-173.1	-107.2	0	0	106.5
467	G	29.8	Very low	34.4	Very low	55 Å²	55	139.6 Å²	139.6	57%	0.567	78%	0.781	S	S	*	*			cis	122.7	121.2	-4.9	0	0	0	0	0	115.1
468	S	35.7	Very low	34.6	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	78%	0.781	S	S	*	*			trans	101.4	149.3	166.3	-58.5	0	0	0	0	118.7
469	T	35.6	Very low	33.8	Very low	135 Å²	135	137.8 Å²	137.8	83%	0.828	78%	0.781	S	S	*	*			cis	-161.3	168.7	-9.3	16.9	0	0	0	0	114
470	S	32.6	Very low	33.7	Very low	107 Å²	107	137 Å²	137	75%	0.748	78%	0.777	S	S	*	*			trans	-76.5	167.4	-177	53	0	0	0	0	119
471	S	29.3	Very low	33.4	Very low	123 Å²	123	141.9 Å²	141.9	86%	0.86	78%	0.784	S	S	*	*			trans	-172.1	169.8	136.8	-87.9	0	0	0	0	114.9
472	L	31.6	Very low	32.6	Very low	163 Å²	163	143.3 Å²	143.3	85%	0.853	78%	0.784	S	S	*	*			trans	-133	145.5	-168	-63.5	162.1	0	0	0	113.4
473	R	30	Very low	32.4	Very low	243 Å²	243	145.6 Å²	145.6	92%	0.917	79%	0.788	S	S	*	*				157.8	152.6	122.1	-88.8	-179.9	169.9	166.3	-1.8	116.7
474	F	32.1	Very low	32.8	Very low	200 Å²	200	143.2 Å²	143.2	88%	0.877	78%	0.782	S	S	*	*			trans	-52.2	151.4	174.9	-69.2	-107	0	0	0	117.6
475	K	23.5	Very low	32.5	Very low	200 Å²	200	146.2 Å²	146.2	87%	0.87	79%	0.788	S	S	*	*				-173	130.3	111.3	-103.5	-174.2	177	-175.7	0	115.6
476	V	27	Very low	31.8	Very low	135 Å²	135	141.1 Å²	141.1	82%	0.818	79%	0.788	S	S	*	*			trans	28.7	132.3	143.6	-162.5	0	0	0	0	121.8
477	S	37.6	Very low	31.7	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	80%	0.795	S	S	*	*			trans	-74.8	169.9	173.9	-28.8	0	0	0	0	115.7
478	P	39.9	Very low	32.3	Very low	132 Å²	132	143.3 Å²	143.3	86%	0.857	80%	0.802	S	S	*	*				-132.9	-161.2	124.1	38.9	-29.2	0	0	0	113.1
479	S	31.4	Very low	31.9	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	80%	0.801	S	S	*	*			trans	-140	174.8	-158.5	-177.3	0	0	0	0	114
480	T	31.4	Very low	31.7	Very low	108 Å²	108	145 Å²	145	66%	0.663	80%	0.795	S	S	*	*			trans	114.8	139.4	145	70.2	0	0	0	0	121.6
481	F	28.5	Very low	31.4	Very low	177 Å²	177	146.5 Å²	146.5	78%	0.776	79%	0.794	S	S	*	*			trans	113.3	119.9	130.3	-84.9	-47.7	0	0	0	124.2
482	L	28.9	Very low	31.4	Very low	160 Å²	160	147.3 Å²	147.3	84%	0.838	79%	0.794	S	S	*	*			trans	82.2	142.7	144.3	-60.9	179	0	0	0	123.6
483	K	33	Very low	31.4	Very low	195 Å²	195	144.4 Å²	144.4	85%	0.848	79%	0.787	S	S	*	*			trans	-99.5	167.8	162.4	-53.4	178.7	179.5	-179.4	0	108.9
484	P	41.1	Very low	32.2	Very low	109 Å²	109	137.4 Å²	137.4	71%	0.708	77%	0.773	S	S	*	*				-156.1	164.5	93.9	40.8	-22.6	0	0	0	117.7
485	I	26	Very low	32.1	Very low	168 Å²	168	133.9 Å²	133.9	86%	0.862	77%	0.768	S	S	*	*			trans	47.1	132.6	136	-62.9	167	0	0	0	118.9
486	A	25.9	Very low	32.7	Very low	90 Å²	90	130 Å²	130	74%	0.744	76%	0.763	S	S	*	*			cis	-149.3	173.9	31	0	0	0	0	0	115.5
487	T	34.1	Very low	33.2	Very low	132 Å²	132	134.8 Å²	134.8	81%	0.81	77%	0.767	S	S	*	*			trans	-121	174.6	160.6	67	0	0	0	0	108.6
488	P	42.6	Very low	33.1	Very low	111 Å²	111	134.9 Å²	134.9	72%	0.721	77%	0.765	S	S	*	*				-139.6	-165.8	62	31.2	-4.7	0	0	0	111.9
489	I	27.2	Very low	32.7	Very low	142 Å²	142	136 Å²	136	73%	0.728	76%	0.764	S	S	*	*			cis	-146.7	121.5	25.5	-70.2	175.7	0	0	0	111.5
490	I	32	Very low	33.4	Very low	137 Å²	137	137.1 Å²	137.1	70%	0.703	77%	0.768	S	S	*	*				46.2	103.8	129.8	-55	174.2	0	0	0	120.1
491	D	25.7	Very low	33.4	Very low	138 Å²	138	140.7 Å²	140.7	74%	0.738	78%	0.777	S	S	*	*				57.5	139.9	116	-57.3	-59.8	0	0	0	124.4
492	V	29.3	Very low	34.9	Very low	141 Å²	141	136.6 Å²	136.6	86%	0.855	77%	0.769	S	S	*	*				-167.9	157.7	96.9	152	0	0	0	0	109.9
493	S	31.6	Very low	35	Very low	101 Å²	101	135.8 Å²	135.8	71%	0.706	76%	0.764	S	S	*	*			trans	-140	-169.4	-175.3	72.7	0	0	0	0	110.1
494	P	46.9	Very low	34.9	Very low	96 Å²	96	136.7 Å²	136.7	62%	0.623	76%	0.762	S	S	*	*			cis	-136.7	-174.1	-23.3	34.6	-14.5	0	0	0	114
495	T	29.9	Very low	34.4	Very low	127 Å²	127	137.5 Å²	137.5	78%	0.779	76%	0.76	S	S	*	*			trans	66.4	174.4	152.5	46.4	0	0	0	0	118.6
496	P	35.9	Very low	34.6	Very low	117 Å²	117	136.9 Å²	136.9	76%	0.76	76%	0.756	S	S	*	*				-128.9	-172.3	-64.2	39.6	-23.7	0	0	0	113.2
497	R	38.1	Very low	34.8	Very low	237 Å²	237	138.5 Å²	138.5	89%	0.894	76%	0.756	S	S	*	*			trans	-75.8	154.7	164.5	-59.2	-173.2	-177.9	-162.1	1.5	110.7
498	P	36.3	Very low	34.6	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	75%	0.754	S	S	*	*				-146.1	167.6	91.6	38.5	-21.7	0	0	0	116.5
499	D	30.7	Very low	33.9	Very low	156 Å²	156	136 Å²	136	83%	0.834	76%	0.759	S	S	*	*			trans	33.7	135.6	145.3	-46	-19.5	0	0	0	123.1
500	P	45.6	Very low	34.1	Very low	129 Å²	129	133.8 Å²	133.8	84%	0.838	76%	0.761	S	S	*	*			trans	-120.7	117.9	171.2	37.5	-24.2	0	0	0	116.3
501	E	32.7	Very low	34	Very low	183 Å²	183	132 Å²	132	86%	0.855	77%	0.767	S	S	*	*			trans	-161.5	162.5	153.7	-114.6	-149.8	-156	0	0	108.6
502	P	58.8	Low	34.2	Very low	91 Å²	91	130.5 Å²	130.5	59%	0.591	77%	0.774	S	S	*	*			cis	-132.5	-158.7	-24.7	25	0	0	0	0	112.6
503	L	31.2	Very low	34.3	Very low	142 Å²	142	128 Å²	128	74%	0.743	77%	0.769	S	S	*	*			trans	89.4	103.1	153.5	-53.7	-178.8	0	0	0	123.6
504	R	32.2	Very low	35.4	Very low	214 Å²	214	128.6 Å²	128.6	81%	0.808	77%	0.77	S	S	*	*				60.4	125.4	108	-76.2	-172.9	178.8	-146.8	1.5	125.3
505	I	29.8	Very low	34.9	Very low	127 Å²	127	129.8 Å²	129.8	65%	0.651	78%	0.775	S	S	*	*			trans	79.1	134.2	136.2	-56.1	160.2	0	0	0	120.7	V507	I505-V507 HydrophobicContact CG2-CG2 3.97Å
506	I	29.1	Very low	35	Very low	155 Å²	155	132 Å²	132	80%	0.795	78%	0.777	S	S	*	*				176.9	117.2	124	-89.6	170.7	0	0	0	109.2
507	V	30.3	Very low	34.9	Very low	123 Å²	123	131 Å²	131	75%	0.745	77%	0.772	S	S	*	*				52.1	149.7	76.4	-100.2	0	0	0	0	117.1	I505	I505-V507 HydrophobicContact CG2-CG2 3.97Å
508	A	30.6	Very low	34.4	Very low	92 Å²	92	125.8 Å²	125.8	76%	0.76	77%	0.767	S	S	*	*			cis	-148.6	-178.1	4.2	0	0	0	0	0	109.8
509	A	28.4	Very low	34.1	Very low	100 Å²	100	128.7 Å²	128.7	83%	0.826	77%	0.771	S	S	*	*			cis	-124.3	-97.3	0.6	0	0	0	0	0	112.6
510	A	30.4	Very low	34	Very low	94 Å²	94	128.3 Å²	128.3	78%	0.777	77%	0.768	S	S	*	*			cis	-169.2	170.8	-5.2	0	0	0	0	0	107.5
511	A	30.9	Very low	33.2	Very low	99 Å²	99	128.1 Å²	128.1	82%	0.818	77%	0.77	S	S	*	*			cis	-178.3	151.9	-31.2	0	0	0	0	0	106.2
512	A	30.5	Very low	33.2	Very low	108 Å²	108	126.6 Å²	126.6	89%	0.893	76%	0.763	S	S	*	*			cis	-145.6	-132.9	-1.5	0	0	0	0	0	111.1
513	A	29.5	Very low	32.3	Very low	89 Å²	89	127.9 Å²	127.9	74%	0.736	77%	0.771	S	S	*	*			trans	-158.9	-151.4	-170.5	0	0	0	0	0	109.8
514	P	55.2	Low	32.2	Very low	112 Å²	112	125 Å²	125	73%	0.727	76%	0.763	S	S	*	*			cis	-147.5	-170.7	-4.3	29.8	-1.5	0	0	0	118.7
515	V	37.4	Very low	32	Very low	122 Å²	122	121.4 Å²	121.4	74%	0.739	77%	0.765	S	S	*	*			trans	74.1	112.9	149.3	-80.5	0	0	0	0	127.1
516	E	32.2	Very low	32	Very low	174 Å²	174	120 Å²	120	81%	0.813	77%	0.767	S	S	*	*				87.4	144.8	110.5	-132	173	164.5	0	0	126.9
517	S	32	Very low	32.2	Very low	94 Å²	94	122.2 Å²	122.2	66%	0.657	77%	0.77	S	S	*	*			trans	106.2	113.4	145	-58.2	0	0	0	0	124.3
518	T	28.7	Very low	32.2	Very low	129 Å²	129	122.1 Å²	122.1	79%	0.791	77%	0.77	S	S	*	*			trans	61.9	112.9	141.1	46.4	0	0	0	0	125.7
519	E	28.9	Very low	32.5	Very low	169 Å²	169	123.9 Å²	123.9	79%	0.79	77%	0.774	S	S	*	*				60.9	144.7	123.4	-70.2	-155.5	164.6	0	0	127.2
520	L	30.1	Very low	32.5	Very low	149 Å²	149	126.3 Å²	126.3	78%	0.78	77%	0.768	S	S	*	*			trans	69.1	99	149.6	-74.7	164.2	0	0	0	121.8
521	S	28.4	Very low	32.6	Very low	124 Å²	124	128.7 Å²	128.7	87%	0.867	76%	0.763	S	S	*	*				-177.2	149.1	108.2	35.3	0	0	0	0	114.1
522	E	31.9	Very low	32.4	Very low	152 Å²	152	133.1 Å²	133.1	71%	0.71	76%	0.764	S	S	*	*			trans	-106.7	172.6	173.6	-116.6	-161.3	-115.8	0	0	109.8	S524	E522-S524 WeakPolarHBondContact OE2-CB 3.34Å; E522-S524 PolarHBondContact OE2-OG 3.06Å
523	P	40.3	Very low	32.2	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	76%	0.756	S	S	*	*			cis	-144.3	131.7	37.8	36.9	-14.3	0	0	0	119.5
524	S	30	Very low	32.2	Very low	82 Å²	82	136.1 Å²	136.1	57%	0.573	76%	0.76	S	S	*	*				53.2	154.2	112.6	-103.1	0	0	0	0	125.6	E522	E522-S524 WeakPolarHBondContact OE2-CB 3.34Å; E522-S524 PolarHBondContact OE2-OG 3.06Å
525	T	28.1	Very low	31.4	Very low	138 Å²	138	136.4 Å²	136.4	85%	0.847	76%	0.761	S	S	*	*			trans	78.5	130	169.6	71.1	0	0	0	0	117.8
526	S	29.1	Very low	31	Very low	99 Å²	99	135.1 Å²	135.1	69%	0.692	76%	0.764	S	S	*	*			cis	-155.7	136.9	-6.9	61.7	0	0	0	0	115.9
527	K	32.3	Very low	30.9	Very low	200 Å²	200	135.2 Å²	135.2	87%	0.87	77%	0.766	S	S	*	*			trans	64.3	103	144.9	-66.6	177.9	179.1	178.9	0	120.3
528	T	31.5	Very low	30.9	Very low	122 Å²	122	139.4 Å²	139.4	75%	0.748	78%	0.775	S	S	*	*			trans	-138	169.5	144	-25.3	0	0	0	0	107.5	E530	T528-E530 HydrophobicContact CG2-CG 4.46Å
529	P	36.8	Very low	31	Very low	129 Å²	129	142.2 Å²	142.2	84%	0.838	78%	0.777	S	S	*	*				-145.2	166.3	104.1	38.3	-23.7	0	0	0	114.7
530	E	28.7	Very low	31.2	Very low	151 Å²	151	140 Å²	140	71%	0.706	78%	0.78	S	S	*	*			trans	-142.5	149.8	-175.2	-95.6	-154.7	103.1	0	0	114	T528	T528-E530 HydrophobicContact CG2-CG 4.46Å
531	Q	31.2	Very low	31.4	Very low	143 Å²	143	137.6 Å²	137.6	67%	0.668	78%	0.781	S	S	*	*			trans	62.2	126.6	148.5	-62.3	-176.9	46	0	0	123.7
532	K	28	Very low	31.6	Very low	192 Å²	192	139.4 Å²	139.4	84%	0.835	78%	0.781	S	S	*	*			trans	35.6	131.6	138.6	-64.4	177.9	174.8	176.2	0	122.6
533	A	26.8	Very low	31.7	Very low	89 Å²	89	142.1 Å²	142.1	74%	0.736	78%	0.784	S	S	*	*				170.2	168.4	99.2	0	0	0	0	0	114.2
534	E	28.1	Very low	31.5	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	79%	0.787	S	S	*	*			trans	65.3	166.2	166.1	-62.9	-62.5	103.4	0	0	118.5
535	P	39.8	Very low	31.6	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	79%	0.791	S	S	*	*				-128.7	-164.6	-68.2	37.8	-20.7	0	0	0	114.4
536	A	29	Very low	31.9	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	77%	0.773	S	S	*	*			trans	-86.8	156	-157.2	0	0	0	0	0	118.3
537	M	29.1	Very low	32.2	Very low	176 Å²	176	143.4 Å²	143.4	87%	0.867	77%	0.77	S	S	*	*			trans	-145.5	137.9	145	-167.3	172.3	67.2	0	0	110.3
538	Q	33.1	Very low	32.2	Very low	182 Å²	182	140.4 Å²	140.4	85%	0.85	76%	0.764	S	S	*	*			trans	-119.5	147.3	-179.6	-69.4	-175.8	-9.7	0	0	111.8
539	K	30.1	Very low	32.1	Very low	187 Å²	187	144.2 Å²	144.2	81%	0.813	77%	0.77	S	S	*	*			trans	-139.6	124.3	157.1	-74.2	-165.9	175.8	-177.4	0	111.8
540	S	33.2	Very low	31.8	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	76%	0.762	S	S	*	*			trans	41.6	102.9	153.8	58.4	0	0	0	0	119.4
541	A	34	Very low	32.2	Very low	99 Å²	99	141.4 Å²	141.4	82%	0.818	77%	0.765	S	S	*	*			trans	-122	131.9	152.8	0	0	0	0	0	109.5	R543	A541-R543 PolarHBondContact O-N 3.48Å
542	L	32	Very low	32.4	Very low	163 Å²	163	144.9 Å²	144.9	85%	0.853	77%	0.772	S	S	*	*			trans	-72.2	108.5	-171.6	-173.7	72.1	0	0	0	111.5	K544	L542-K544 PolarHBondContact O-N 2.73Å; L542-K544 VanDerWaalsContact O-N 3.15Å
543	R	33.4	Very low	33	Very low	209 Å²	209	144.7 Å²	144.7	79%	0.789	77%	0.774	S	S	*	*			trans	-72.1	104.6	171.5	-81.1	-169.6	174.8	-168.8	1.3	110.7	A541 H545	A541-R543 PolarHBondContact O-N 3.48Å; R543-H545 PolarHBondContact O-N 3.14Å
544	K	36.3	Very low	33.8	Very low	187 Å²	187	145.6 Å²	145.6	81%	0.813	76%	0.763	S	S	*	*			trans	-72.1	116.1	151.2	-68	-172.8	178.1	-174	0	107.7	L542 A546	L542-K544 PolarHBondContact O-N 2.73Å; L542-K544 VanDerWaalsContact O-N 3.15Å; K544-A546 PolarHBondContact O-N 2.77Å
545	H	32.9	Very low	34.6	Very low	140 Å²	140	144.7 Å²	144.7	65%	0.648	76%	0.762	S	S	*	*			trans	-72.9	82.6	165.8	-89.7	-116.7	0	0	0	108.8	R543	R543-H545 PolarHBondContact O-N 3.14Å
546	A	35.2	Very low	34.9	Very low	57 Å²	57	146.1 Å²	146.1	47%	0.471	76%	0.757	S	S	.	*			trans	-63	134.3	148.4	0	0	0	0	0	107.1	K544 N548	K544-A546 PolarHBondContact O-N 2.77Å; A546-N548 PolarHBondContact O-N 2.8Å
547	A	35	Very low	36	Very low	78 Å²	78	146.1 Å²	146.1	65%	0.645	74%	0.742	S	S	*	*			trans	-66.9	71	164.2	0	0	0	0	0	109	F549	A547-F549 VanDerWaalsContact C-N 3.32Å; A547-F549 PolarHBondContact O-N 3Å
548	N	31.8	Very low	36.8	Very low	138 Å²	138	143.7 Å²	143.7	74%	0.738	74%	0.739	S	S	*	*			trans	-65.4	95	177.6	-81.8	-21.1	0	0	0	107.6	A546 S550	A546-N548 PolarHBondContact O-N 2.8Å; N548-S550 PolarHBondContact O-N 3.22Å
549	F	29.2	Very low	38	Very low	201 Å²	201	138.6 Å²	138.6	88%	0.882	74%	0.736	S	S	*	*			trans	-61.3	90.9	162.5	-146.3	-80.3	0	0	0	106.8	A547 V551	A547-F549 VanDerWaalsContact C-N 3.32Å; A547-F549 PolarHBondContact O-N 3Å; F549-V551 VanDerWaalsContact C-N 3.26Å; F549-V551 PolarHBondContact O-N 3.41Å
550	S	30	Very low	39.3	Very low	93 Å²	93	135.2 Å²	135.2	65%	0.65	73%	0.725	S	S	*	*			trans	-70.8	88.6	-172.1	-172.1	0	0	0	0	108.7	N548 R552	N548-S550 PolarHBondContact O-N 3.22Å; S550-R552 PolarHBondContact O-N 3.1Å
551	V	37.4	Very low	40.7	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	73%	0.726	S	S	*	*			trans	-53.4	96.6	145.5	179.9	0	0	0	0	104.5	F549 E553	F549-V551 VanDerWaalsContact C-N 3.26Å; F549-V551 PolarHBondContact O-N 3.41Å; V551-E553 PolarHBondContact O-N 3.39Å
552	R	35.9	Very low	42.2	Very low	217 Å²	217	143 Å²	143	82%	0.819	72%	0.715	S	S	*	*			trans	-45.1	116.2	176.3	-89.1	175.8	154.9	166	-7	107.5	S550 E554	S550-R552 PolarHBondContact O-N 3.1Å; R552-E554 PolarHBondContact O-N 2.69Å
553	E	41.5	Very low	43.9	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	72%	0.715	S	S	*	*			trans	-57.3	114	164	-72	-169.6	112.3	0	0	106.2	V551 I555	V551-E553 PolarHBondContact O-N 3.39Å; E553-I555 PolarHBondContact O-N 2.82Å
554	E	43.4	Very low	45.8	Very low	108 Å²	108	143.6 Å²	143.6	51%	0.505	72%	0.716	S	S	.	*			trans	-62.5	109.2	-176.2	-70.7	-178.4	140.7	0	0	107.8	R552 F556 R562	R552-E554 PolarHBondContact O-N 2.69Å; E554-F556 PolarHBondContact O-N 3.36Å; E554-R562 VanDerWaalsContact OE2-CD 3.3Å; E554-R562 WeakPolarHBondContact OE2-CD 3.36Å; E554-R562 WeakPolarHBondContact OE2-CG 3.47Å; E554-R562 IonicContact OE2-CZ 3.48Å; E554-R562 IonicContact OE2-NE 2.73Å; E554-R562 PolarHBondContact OE2-NE 3.15Å; E554-R562 IonicContact OE2-NH2 3.38Å
555	I	45.1	Very low	47.7	Very low	152 Å²	152	141.4 Å²	141.4	78%	0.779	71%	0.712	S	S	*	*			trans	-50.7	108.3	161	-60.4	174.8	0	0	0	105.2	E553 I557	E553-I555 PolarHBondContact O-N 2.82Å; I555-I557 HydrophobicContact CG2-CG1 4.13Å; I555-I557 PolarHBondContact O-N 2.86Å
556	F	44.5	Very low	49.7	Very low	148 Å²	148	145.6 Å²	145.6	65%	0.649	72%	0.722	S	S	*	*			trans	-82	66.7	-162.5	-161.6	-95.5	0	0	0	110.4	E554 P558	E554-F556 PolarHBondContact O-N 3.36Å; F556-P558 WeakPolarHBondContact O-CD 3.19Å; F556-P558 VanDerWaalsContact O-N 3.12Å
557	I	52.8	Low	51.8	Low	96 Å²	96	150.6 Å²	150.6	49%	0.492	73%	0.734	S	S	.	*			trans	-58.9	111.7	179.6	-62.7	173.9	0	0	0	108.1	I555 G559 I560	I555-I557 HydrophobicContact CG2-CG1 4.13Å; I555-I557 PolarHBondContact O-N 2.86Å; I557-G559 PolarHBondContact O-N 3.08Å; I557-I560 HydrophobicContact CB-CD1 3.91Å; I557-I560 HydrophobicContact CB-CG1 4.11Å; I557-I560 HydrophobicContact CD1-CD1 3.88Å; I557-I560 HydrophobicContact CG1-CD1 4.46Å; I557-I560 HydrophobicContact CG2-CD1 3.92Å; I557-I560 HydrophobicContact CG2-CG1 3.96Å; I557-I560 PolarHBondContact O-N 3.36Å; I557-I560 VanDerWaalsContact O-N 3.15Å
558	P	45.3	Very low	53.8	Low	124 Å²	124	151 Å²	151	81%	0.805	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	111.4	-174.6	-23.4	35.5	0	0	0	110.7	F556	F556-P558 WeakPolarHBondContact O-CD 3.19Å; F556-P558 VanDerWaalsContact O-N 3.12Å
559	G	58.4	Low	56.1	Low	75 Å²	75	145.1 Å²	145.1	77%	0.773	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	123.8	-25	-179	0	0	0	0	0	114.5	I557 R561	I557-G559 PolarHBondContact O-N 3.08Å; G559-R561 PolarHBondContact O-N 3.17Å
560	I	58.9	Low	58.6	Low	116 Å²	116	139.1 Å²	139.1	60%	0.595	68%	0.681	S	S	*	*			trans	-75.6	97.1	174.7	-56.6	-174.2	0	0	0	109.1	I557 R562	I557-I560 HydrophobicContact CB-CD1 3.91Å; I557-I560 HydrophobicContact CB-CG1 4.11Å; I557-I560 HydrophobicContact CD1-CD1 3.88Å; I557-I560 HydrophobicContact CG1-CD1 4.46Å; I557-I560 HydrophobicContact CG2-CD1 3.92Å; I557-I560 HydrophobicContact CG2-CG1 3.96Å; I557-I560 PolarHBondContact O-N 3.36Å; I557-I560 VanDerWaalsContact O-N 3.15Å; I560-R562 PolarHBondContact O-N 3.44Å; I560-R562 VanDerWaalsContact O-N 3.14Å
561	R	62.7	Low	61.3	Low	230 Å²	230	139.7 Å²	139.7	87%	0.868	67%	0.673	S	S	*	*			trans	-59.3	117.3	169.3	-66.5	-180	178.7	175.7	0.3	108.8	G559 K563	G559-R561 PolarHBondContact O-N 3.17Å; R561-K563 PolarHBondContact O-N 3.48Å; R561-K563 VanDerWaalsContact O-N 3.13Å
562	R	63.9	Low	63.6	Low	156 Å²	156	134.8 Å²	134.8	59%	0.589	64%	0.643	S	S	*	*			trans	-41.8	120.9	171.6	-65.7	-171.9	178.3	146.7	3.9	110	E554 I560 K564	E554-R562 VanDerWaalsContact OE2-CD 3.3Å; E554-R562 WeakPolarHBondContact OE2-CD 3.36Å; E554-R562 WeakPolarHBondContact OE2-CG 3.47Å; E554-R562 IonicContact OE2-CZ 3.48Å; E554-R562 IonicContact OE2-NE 2.73Å; E554-R562 PolarHBondContact OE2-NE 3.15Å; E554-R562 IonicContact OE2-NH2 3.38Å; I560-R562 PolarHBondContact O-N 3.44Å; I560-R562 VanDerWaalsContact O-N 3.14Å; R562-K564 VanDerWaalsContact C-N 3.29Å; R562-K564 PolarHBondContact O-N 3.46Å
563	K	69.1	Low	65.9	Low	196 Å²	196	128.4 Å²	128.4	85%	0.852	62%	0.622	S	S	*	*			trans	-70	85.1	-178	-71	-176.7	179.8	178.2	0	109.6	R561 I565	R561-K563 PolarHBondContact O-N 3.48Å; R561-K563 VanDerWaalsContact O-N 3.13Å; K563-I565 PolarHBondContact O-N 3.19Å
564	K	73.6	Confident	67.8	Low	188 Å²	188	121.2 Å²	121.2	82%	0.817	59%	0.588	S	S	*	*			trans	-59.9	108	177.6	-67.9	-172.7	178.8	-175.4	0	109.5	R562 R566	R562-K564 VanDerWaalsContact C-N 3.29Å; R562-K564 PolarHBondContact O-N 3.46Å; K564-R566 PolarHBondContact O-N 2.85Å
565	I	76	Confident	69.8	Low	141 Å²	141	119.3 Å²	119.3	72%	0.723	58%	0.578	S	S	*	*			trans	-58.6	121.8	173	-60.5	174.9	0	0	0	107.9	K563 F567	K563-I565 PolarHBondContact O-N 3.19Å; I565-F567 HydrophobicContact CG2-CE1 4.11Å; I565-F567 HydrophobicContact CG2-CE2 4.14Å; I565-F567 HydrophobicContact CG2-CZ 3.88Å
566	R	73.6	Confident	71.2	Confident	227 Å²	227	115.9 Å²	115.9	86%	0.857	56%	0.561	S	S	*	*			trans	-115.3	107	175.6	-70.3	-175	67.2	-166.8	-1.3	108.5	K564 S568	K564-R566 PolarHBondContact O-N 2.85Å; R566-S568 PolarHBondContact O-N 2.94Å
567	F	78.8	Confident	72.7	Confident	163 Å²	163	116 Å²	116	72%	0.715	56%	0.557	S	S	*	*			trans	-67.4	125.4	169.7	-54.9	-79.8	0	0	0	109.2	I565 L606	I565-F567 HydrophobicContact CG2-CE1 4.11Å; I565-F567 HydrophobicContact CG2-CE2 4.14Å; I565-F567 HydrophobicContact CG2-CZ 3.88Å; F567-L606 HydrophobicContact CB-CD1 3.66Å
568	S	78	Confident	73.4	Confident	85 Å²	85	116.8 Å²	116.8	59%	0.594	55%	0.554	S	S	*	*			trans	-76.7	-52.4	178.9	50.2	0	0	0	0	110.9	R566 Y603 L606	R566-S568 PolarHBondContact O-N 2.94Å; S568-Y603 VanDerWaalsContact C-OH 3.31Å; S568-Y603 PolarHBondContact O-OH 2.97Å; S568-L606 PolarHBondContact O-N 2.87Å
569	G	79.3	Confident	74.4	Confident	16 Å²	16	112.9 Å²	112.9	17%	0.165	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	-175.4	177.5	0	0	0	0	0	112.2	Y603 F604	G569-Y603 WeakPolarHBondContact CA-OH 3.32Å; G569-Y603 PolarHBondContact N-OH 3.31Å; G569-F604 CarbonylContact C-O 3.56Å; G569-F604 WeakPolarHBondContact CA-O 3.5Å
570	L	83.1	Confident	74.6	Confident	75 Å²	75	109.6 Å²	109.6	39%	0.393	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.3	178.5	177	69.6	0	0	0	109	V572 Y603 F604 P612	L570-V572 HydrophobicContact CD2-CG2 3.81Å; L570-V572 HydrophobicContact CG-CG2 3.86Å; L570-Y603 WeakPolarHBondContact O-CA 3.24Å; L570-F604 PolarHBondContact N-O 2.89Å; L570-F604 PolarHBondContact O-N 2.85Å; L570-P612 HydrophobicContact CD2-CG 4.23Å
571	H	85.6	Confident	74.4	Confident	105 Å²	105	107.3 Å²	107.3	49%	0.486	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.7	165.3	-65.9	-87	0	0	0	109.2	H601 Y603	H571-H601 AromaticContact CG-NE2 3.73Å; H571-H601 AromaticContact ND1-CE1 3.39Å; H571-H601 PolarHBondContact ND1-CE1 3.22Å; H571-H601 AromaticContact ND1-NE2 3.1Å; H571-H601 PolarHBondContact ND1-NE2 2.83Å; H571-H601 VanDerWaalsContact ND1-NE2 3.1Å; H571-Y603 AromaticContact CD2-CD2 3.93Å; H571-Y603 AromaticContact CE1-CD2 3.39Å; H571-Y603 WeakPolarHBondContact CE1-CD2 3.48Å; H571-Y603 AromaticContact CE1-CE2 3.98Å; H571-Y603 AromaticContact ND1-CD2 3.68Å; H571-Y603 AromaticContact NE2-CD2 3.51Å; H571-Y603 AromaticContact NE2-CE2 3.68Å
572	V	85.3	Confident	74	Confident	25 Å²	25	101.4 Å²	101.4	15%	0.152	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.8	176.4	-179.8	0	0	0	0	108.2	L570 Y574 H601 R602 F604 L614	L570-V572 HydrophobicContact CD2-CG2 3.81Å; L570-V572 HydrophobicContact CG-CG2 3.86Å; V572-Y574 HydrophobicContact CB-CE2 4.21Å; V572-Y574 HydrophobicContact CG1-CD2 4.22Å; V572-Y574 HydrophobicContact CG1-CE1 4.3Å; V572-Y574 HydrophobicContact CG1-CE2 3.65Å; V572-H601 CarbonylContact O-C 3.59Å; V572-H601 WeakPolarHBondContact O-CA 3.26Å; V572-R602 PolarHBondContact N-O 2.82Å; V572-R602 PolarHBondContact O-N 3.41Å; V572-F604 HydrophobicContact CB-CD2 4.45Å; V572-F604 HydrophobicContact CB-CE2 4.01Å; V572-F604 HydrophobicContact CG2-CD2 3.78Å; V572-F604 HydrophobicContact CG2-CE2 3.69Å; V572-L614 HydrophobicContact CG1-CD2 4.31Å
573	H	84.5	Confident	73.5	Confident	83 Å²	83	97.1 Å²	97.1	38%	0.384	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.6	174.2	-62.1	-98.7	0	0	0	108.7	F575 H598 H601	H573-F575 HydrophobicContact CB-CD2 4.2Å; H573-F575 HydrophobicContact CB-CE2 3.48Å; H573-F575 VanDerWaalsContact CB-CE2 3.48Å; H573-F575 HydrophobicContact CB-CZ 3.99Å; H573-H598 HydrophobicContact CB-CB 3.99Å; H573-H598 AromaticContact CE1-CE1 3.79Å; H573-H598 AromaticContact CE1-NE2 3.81Å; H573-H598 AromaticContact ND1-CD2 3.46Å; H573-H598 PolarHBondContact ND1-CD2 3.18Å; H573-H598 AromaticContact ND1-CE1 3.19Å; H573-H598 PolarHBondContact ND1-CE1 3.45Å; H573-H598 AromaticContact ND1-CG 3.61Å; H573-H598 AromaticContact ND1-ND1 3.44Å; H573-H598 PolarHBondContact ND1-ND1 3.05Å; H573-H598 AromaticContact ND1-NE2 3.15Å; H573-H598 PolarHBondContact ND1-NE2 3.4Å; H573-H598 VanDerWaalsContact ND1-NE2 3.15Å; H573-H601 AromaticContact CD2-CD2 3.82Å; H573-H601 AromaticContact CE1-CD2 3.17Å; H573-H601 PolarHBondContact CE1-CD2 3.17Å; H573-H601 AromaticContact CE1-CG 3.96Å; H573-H601 AromaticContact CE1-NE2 3.6Å; H573-H601 AromaticContact CG-CD2 3.87Å; H573-H601 AromaticContact ND1-CD2 3.48Å; H573-H601 PolarHBondContact ND1-CD2 3.17Å; H573-H601 AromaticContact NE2-CD2 3.36Å; H573-H601 PolarHBondContact NE2-CD2 3.44Å; H573-H601 AromaticContact NE2-NE2 3.56Å
574	Y	81.5	Confident	72.9	Confident	37 Å²	37	90.2 Å²	90.2	15%	0.145	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122	179.8	-60.8	-99.7	0	0	0	108.5	V572 H598 H599 S600 R602 L614	V572-Y574 HydrophobicContact CB-CE2 4.21Å; V572-Y574 HydrophobicContact CG1-CD2 4.22Å; V572-Y574 HydrophobicContact CG1-CE1 4.3Å; V572-Y574 HydrophobicContact CG1-CE2 3.65Å; Y574-H598 CarbonylContact O-C 3.55Å; Y574-H598 VanDerWaalsContact O-CA 3.24Å; Y574-H598 WeakPolarHBondContact O-CA 3.45Å; Y574-H598 WeakPolarHBondContact O-CB 3.34Å; Y574-H599 WeakPolarHBondContact CB-NE2 3.4Å; Y574-H599 PolarHBondContact O-N 3.2Å; Y574-S600 PolarHBondContact N-O 2.67Å; Y574-S600 PolarHBondContact O-N 2.9Å; Y574-R602 HydrophobicContact CE2-CB 4.1Å; Y574-R602 HydrophobicContact CE2-CG 3.82Å; Y574-L614 HydrophobicContact CE1-CD2 4.31Å
575	F	85.4	Confident	72	Confident	68 Å²	68	83.5 Å²	83.5	30%	0.298	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144.7	-177.3	-61.1	-101	0	0	0	109.2	H573 M594 H595 H598	H573-F575 HydrophobicContact CB-CD2 4.2Å; H573-F575 HydrophobicContact CB-CE2 3.48Å; H573-F575 VanDerWaalsContact CB-CE2 3.48Å; H573-F575 HydrophobicContact CB-CZ 3.99Å; F575-M594 HydrophobicContact CB-CB 4.2Å; F575-M594 HydrophobicContact CB-CE 3.92Å; F575-M594 HydrophobicContact CD1-CE 4.3Å; F575-M594 HydrophobicContact CD2-CE 3.15Å; F575-M594 HydrophobicContact CE2-CE 3.55Å; F575-M594 HydrophobicContact CG-CE 3.57Å; F575-M594 HydrophobicContact CZ-CE 4.27Å; F575-H595 WeakPolarHBondContact CD1-O 3.21Å; F575-H598 HydrophobicContact CD1-CB 3.7Å; F575-H598 HydrophobicContact CD2-CB 4.15Å; F575-H598 HydrophobicContact CE1-CB 3.68Å; F575-H598 HydrophobicContact CE2-CB 4.14Å; F575-H598 HydrophobicContact CG-CB 3.97Å; F575-H598 HydrophobicContact CZ-CB 3.91Å
576	D	75.9	Confident	70.9	Confident	79 Å²	79	81.5 Å²	81.5	42%	0.422	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	138.1	171.8	-55.9	-59.2	0	0	0	109.9	R578 H595 H599	D576-R578 PolarHBondContact O-N 2.96Å; D576-H595 HydrophobicContact CB-CB 4.16Å; D576-H595 PolarHBondContact O-N 2.77Å; D576-H599 VanDerWaalsContact CG-ND1 3.26Å; D576-H599 IonicContact OD1-CE1 2.72Å; D576-H599 PolarHBondContact OD1-CE1 3.41Å; D576-H599 VanDerWaalsContact OD1-CE1 3.31Å; D576-H599 IonicContact OD1-CG 2.91Å; D576-H599 IonicContact OD1-ND1 3.6Å; D576-H599 PolarHBondContact OD1-ND1 3.26Å; D576-H599 IonicContact OD2-CG 2.79Å; D576-H599 IonicContact OD2-ND1 3.56Å; D576-H599 PolarHBondContact OD2-ND1 3.39Å
577	R	74.1	Confident	69.5	Low	152 Å²	152	79 Å²	79	57%	0.574	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	127.7	-179.2	-58.6	175.1	175.9	-93.1	3.1	109	I649	R577-I649 HydrophobicContact CB-CD1 3.56Å; R577-I649 HydrophobicContact CB-CG1 3.99Å; R577-I649 HydrophobicContact CG-CD1 4.4Å
578	R	68	Low	68.3	Low	111 Å²	111	74.1 Å²	74.1	42%	0.419	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	166	170.9	-64.9	-177.9	77.7	-164	8.2	110.4	D576 D593 H595 N596	D576-R578 PolarHBondContact O-N 2.96Å; R578-D593 HydrophobicContact CB-CB 4.06Å; R578-D593 PolarHBondContact N-O 3.2Å; R578-D593 PolarHBondContact O-N 3.31Å; R578-H595 HydrophobicContact CG-CB 4.28Å; R578-N596 PolarHBondContact NH1-OD1 2.82Å; R578-N596 VanDerWaalsContact NH1-OD1 3.13Å
579	Q	66.1	Low	67	Low	43 Å²	43	75 Å²	75	20%	0.201	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	128.4	160.3	161.9	155.5	8.7	0	0	108.5	I590 R657	Q579-I590 HydrophobicContact CB-CG2 3.87Å; Q579-I590 HydrophobicContact CG-CG2 3.52Å; Q579-R657 VanDerWaalsContact NE2-NE 3.18Å
580	G	62.4	Low	66	Low	6 Å²	6	75.7 Å²	75.7	6%	0.062	42%	0.416	C	S	.	.			trans	-65.6	133.6	172.3	0	0	0	0	0	111.4	S591	G580-S591 PolarHBondContact N-O 2.84Å; G580-S591 PolarHBondContact O-OG 2.91Å
581	G	54.8	Low	64.9	Low	67 Å²	67	74 Å²	74	69%	0.691	41%	0.411	S	S	*	.	S	Bend	trans	-86.9	-8.1	-178	0	0	0	0	0	115.4	T583	G581-T583 PolarHBondContact O-N 3.26Å
582	S	54.5	Low	64	Low	106 Å²	106	74.6 Å²	74.6	74%	0.741	42%	0.417	S	S	*	.	S	Bend	trans	-71.3	-23.6	-169.5	51.6	0	0	0	0	115.1
583	T	53.9	Low	63.3	Low	67 Å²	67	76.7 Å²	76.7	41%	0.411	43%	0.427	S	S	.	.			trans	-144.7	137.7	177.5	55.5	0	0	0	0	112.9	G581 P585	G581-T583 PolarHBondContact O-N 3.26Å; T583-P585 WeakPolarHBondContact O-CD 3.24Å
584	V	56.7	Low	63.2	Low	50 Å²	50	77.8 Å²	77.8	30%	0.303	43%	0.434	S	S	.	.			trans	-108	85.5	159.2	-179.7	0	0	0	0	107.4	Q654 R657 L661	V584-Q654 HydrophobicContact CG1-CG 4.37Å; V584-R657 HydrophobicContact CG2-CG 4.22Å; V584-L661 HydrophobicContact CG2-CD1 3.52Å
585	P	55	Low	63.1	Low	47 Å²	47	79.6 Å²	79.6	31%	0.305	44%	0.444	S	S	.	.			trans	-66.7	144.8	176.7	31.7	-37.1	0	0	0	109.7	T583 E587	T583-P585 WeakPolarHBondContact O-CD 3.24Å; P585-E587 WeakPolarHBondContact CB-O 3.16Å; P585-E587 PolarHBondContact O-N 3.3Å
586	T	51.9	Low	62.9	Low	99 Å²	99	82.7 Å²	82.7	61%	0.607	46%	0.463	S	S	*	.	S	Bend	trans	-65	-33.3	177.9	-34.7	0	0	0	0	111.5
587	E	45.4	Very low	63.1	Low	175 Å²	175	86.5 Å²	86.5	82%	0.818	48%	0.476	S	S	*	.	S	Bend	trans	-131.6	151.1	178.8	-62.6	-175.5	-176.1	0	0	110.2	P585	P585-E587 WeakPolarHBondContact CB-O 3.16Å; P585-E587 PolarHBondContact O-N 3.3Å
588	G	51.8	Low	63.6	Low	60 Å²	60	83.3 Å²	83.3	62%	0.619	47%	0.468	S	S	*	.	S	Bend	trans	101	-175.3	175.2	0	0	0	0	0	115.6
589	D	51.8	Low	64.3	Low	103 Å²	103	82.8 Å²	82.8	55%	0.551	47%	0.469	S	S	*	.			trans	-84.4	156.9	-171.3	-79	11.1	0	0	0	112.5	R651	D589-R651 IonicContact OD1-CZ 3.26Å; D589-R651 VanDerWaalsContact OD1-CZ 3.28Å; D589-R651 IonicContact OD1-NH1 2.85Å; D589-R651 PolarHBondContact OD1-NH1 3.36Å; D589-R651 IonicContact OD1-NH2 3.97Å; D589-R651 PolarHBondContact OD1-NH2 2.91Å; D589-R651 VanDerWaalsContact OD1-NH2 3.07Å; D589-R651 IonicContact OD2-CZ 2.67Å; D589-R651 IonicContact OD2-NH1 2.63Å; D589-R651 IonicContact OD2-NH2 3.29Å; D589-R651 PolarHBondContact OD2-NH2 2.99Å
590	I	57.4	Low	65	Low	32 Å²	32	82.2 Å²	82.2	16%	0.164	47%	0.47	C	S	.	.			trans	-68.5	131.3	175.8	-71.7	162.8	0	0	0	109.6	Q579 L592 I652	Q579-I590 HydrophobicContact CB-CG2 3.87Å; Q579-I590 HydrophobicContact CG-CG2 3.52Å; I590-L592 PolarHBondContact O-N 2.86Å; I590-L592 VanDerWaalsContact O-N 3.12Å; I590-I652 HydrophobicContact CD1-CB 4.34Å
591	S	60.5	Low	66.1	Low	40 Å²	40	86 Å²	86	28%	0.28	49%	0.486	S	S	.	.			trans	-58	113.5	166.2	45.3	0	0	0	0	109.9	G580	G580-S591 PolarHBondContact N-O 2.84Å; G580-S591 PolarHBondContact O-OG 2.91Å
592	L	67.2	Low	67.4	Low	116 Å²	116	86.7 Å²	86.7	61%	0.607	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	133	173.1	-68.8	175	0	0	0	109.5	I590 I649	I590-L592 PolarHBondContact O-N 2.86Å; I590-L592 VanDerWaalsContact O-N 3.12Å; L592-I649 HydrophobicContact CD2-CD1 3.44Å; L592-I649 VanDerWaalsContact CD2-CD1 3.44Å
593	D	70.1	Confident	68.7	Low	69 Å²	69	86.8 Å²	86.8	37%	0.369	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	170.9	179	-170.6	15.9	0	0	0	109.5	R578	R578-D593 HydrophobicContact CB-CB 4.06Å; R578-D593 PolarHBondContact N-O 3.2Å; R578-D593 PolarHBondContact O-N 3.31Å
594	M	82.2	Confident	69.9	Low	106 Å²	106	85.8 Å²	85.8	52%	0.522	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	147.3	-177.3	-68	169	60.6	0	0	109.9	F575	F575-M594 HydrophobicContact CB-CB 4.2Å; F575-M594 HydrophobicContact CB-CE 3.92Å; F575-M594 HydrophobicContact CD1-CE 4.3Å; F575-M594 HydrophobicContact CD2-CE 3.15Å; F575-M594 HydrophobicContact CE2-CE 3.55Å; F575-M594 HydrophobicContact CG-CE 3.57Å; F575-M594 HydrophobicContact CZ-CE 4.27Å
595	H	79.3	Confident	70.9	Confident	76 Å²	76	85.9 Å²	85.9	35%	0.352	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	144.4	173.6	-165.9	-93.9	0	0	0	111.5	F575 D576 R578 K597	F575-H595 WeakPolarHBondContact CD1-O 3.21Å; D576-H595 HydrophobicContact CB-CB 4.16Å; D576-H595 PolarHBondContact O-N 2.77Å; R578-H595 HydrophobicContact CG-CB 4.28Å; H595-K597 PolarHBondContact ND1-N 3.12Å; H595-K597 PolarHBondContact ND1-O 3.08Å; H595-K597 PolarHBondContact O-N 2.8Å
596	N	80.9	Confident	71.8	Confident	133 Å²	133	87 Å²	87	71%	0.711	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	-1.1	-176.5	-58.9	39.4	0	0	0	113.6	R578	R578-N596 PolarHBondContact NH1-OD1 2.82Å; R578-N596 VanDerWaalsContact NH1-OD1 3.13Å
597	K	81.7	Confident	72.5	Confident	159 Å²	159	87.1 Å²	87.1	69%	0.691	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	141.6	176.9	-62.3	-177.5	179.8	179.5	0	108.2	H595	H595-K597 PolarHBondContact ND1-N 3.12Å; H595-K597 PolarHBondContact ND1-O 3.08Å; H595-K597 PolarHBondContact O-N 2.8Å
598	H	83	Confident	73.2	Confident	85 Å²	85	83.3 Å²	83.3	39%	0.394	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	139.9	172.9	56	-88.2	0	0	0	110.4	H573 Y574 F575	H573-H598 HydrophobicContact CB-CB 3.99Å; H573-H598 AromaticContact CE1-CE1 3.79Å; H573-H598 AromaticContact CE1-NE2 3.81Å; H573-H598 AromaticContact ND1-CD2 3.46Å; H573-H598 PolarHBondContact ND1-CD2 3.18Å; H573-H598 AromaticContact ND1-CE1 3.19Å; H573-H598 PolarHBondContact ND1-CE1 3.45Å; H573-H598 AromaticContact ND1-CG 3.61Å; H573-H598 AromaticContact ND1-ND1 3.44Å; H573-H598 PolarHBondContact ND1-ND1 3.05Å; H573-H598 AromaticContact ND1-NE2 3.15Å; H573-H598 PolarHBondContact ND1-NE2 3.4Å; H573-H598 VanDerWaalsContact ND1-NE2 3.15Å; Y574-H598 CarbonylContact O-C 3.55Å; Y574-H598 VanDerWaalsContact O-CA 3.24Å; Y574-H598 WeakPolarHBondContact O-CA 3.45Å; Y574-H598 WeakPolarHBondContact O-CB 3.34Å; F575-H598 HydrophobicContact CD1-CB 3.7Å; F575-H598 HydrophobicContact CD2-CB 4.15Å; F575-H598 HydrophobicContact CE1-CB 3.68Å; F575-H598 HydrophobicContact CE2-CB 4.14Å; F575-H598 HydrophobicContact CG-CB 3.97Å; F575-H598 HydrophobicContact CZ-CB 3.91Å
599	H	83.6	Confident	73.6	Confident	99 Å²	99	84 Å²	84	46%	0.458	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-22.8	175.6	64.7	-117.7	0	0	0	112.5	Y574 D576	Y574-H599 WeakPolarHBondContact CB-NE2 3.4Å; Y574-H599 PolarHBondContact O-N 3.2Å; D576-H599 VanDerWaalsContact CG-ND1 3.26Å; D576-H599 IonicContact OD1-CE1 2.72Å; D576-H599 PolarHBondContact OD1-CE1 3.41Å; D576-H599 VanDerWaalsContact OD1-CE1 3.31Å; D576-H599 IonicContact OD1-CG 2.91Å; D576-H599 IonicContact OD1-ND1 3.6Å; D576-H599 PolarHBondContact OD1-ND1 3.26Å; D576-H599 IonicContact OD2-CG 2.79Å; D576-H599 IonicContact OD2-ND1 3.56Å; D576-H599 PolarHBondContact OD2-ND1 3.39Å
600	S	81.9	Confident	73.9	Confident	32 Å²	32	86.9 Å²	86.9	22%	0.224	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.1	178.4	-172.3	0	0	0	0	111.9	Y574	Y574-S600 PolarHBondContact N-O 2.67Å; Y574-S600 PolarHBondContact O-N 2.9Å
601	H	84.9	Confident	73.8	Confident	84 Å²	84	92.5 Å²	92.5	39%	0.389	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	137.4	174.9	171.9	-118.6	0	0	0	109	H571 V572 H573	H571-H601 AromaticContact CG-NE2 3.73Å; H571-H601 AromaticContact ND1-CE1 3.39Å; H571-H601 PolarHBondContact ND1-CE1 3.22Å; H571-H601 AromaticContact ND1-NE2 3.1Å; H571-H601 PolarHBondContact ND1-NE2 2.83Å; H571-H601 VanDerWaalsContact ND1-NE2 3.1Å; V572-H601 CarbonylContact O-C 3.59Å; V572-H601 WeakPolarHBondContact O-CA 3.26Å; H573-H601 AromaticContact CD2-CD2 3.82Å; H573-H601 AromaticContact CE1-CD2 3.17Å; H573-H601 PolarHBondContact CE1-CD2 3.17Å; H573-H601 AromaticContact CE1-CG 3.96Å; H573-H601 AromaticContact CE1-NE2 3.6Å; H573-H601 AromaticContact CG-CD2 3.87Å; H573-H601 AromaticContact ND1-CD2 3.48Å; H573-H601 PolarHBondContact ND1-CD2 3.17Å; H573-H601 AromaticContact NE2-CD2 3.36Å; H573-H601 PolarHBondContact NE2-CD2 3.44Å; H573-H601 AromaticContact NE2-NE2 3.56Å
602	R	80.9	Confident	73.7	Confident	83 Å²	83	91.7 Å²	91.7	31%	0.313	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.4	174.7	-60.7	-175.4	-171.8	-167.2	2.8	110	V572 Y574 F604 Y619	V572-R602 PolarHBondContact N-O 2.82Å; V572-R602 PolarHBondContact O-N 3.41Å; Y574-R602 HydrophobicContact CE2-CB 4.1Å; Y574-R602 HydrophobicContact CE2-CG 3.82Å; R602-F604 HydrophobicContact CB-CE1 4.49Å; R602-F604 HydrophobicContact CB-CE2 3.84Å; R602-F604 HydrophobicContact CB-CZ 3.78Å; R602-Y619 PolarHBondContact NH2-OH 2.82Å
603	Y	82.1	Confident	73.3	Confident	108 Å²	108	93.3 Å²	93.3	42%	0.424	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.2	171.2	176.5	-103.9	0	0	0	110.5	S568 G569 L570 H571	S568-Y603 VanDerWaalsContact C-OH 3.31Å; S568-Y603 PolarHBondContact O-OH 2.97Å; G569-Y603 WeakPolarHBondContact CA-OH 3.32Å; G569-Y603 PolarHBondContact N-OH 3.31Å; L570-Y603 WeakPolarHBondContact O-CA 3.24Å; H571-Y603 AromaticContact CD2-CD2 3.93Å; H571-Y603 AromaticContact CE1-CD2 3.39Å; H571-Y603 WeakPolarHBondContact CE1-CD2 3.48Å; H571-Y603 AromaticContact CE1-CE2 3.98Å; H571-Y603 AromaticContact ND1-CD2 3.68Å; H571-Y603 AromaticContact NE2-CD2 3.51Å; H571-Y603 AromaticContact NE2-CE2 3.68Å
604	F	80	Confident	72.8	Confident	45 Å²	45	94 Å²	94	20%	0.197	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	114.9	178	-58.5	-74.5	0	0	0	110.3	G569 L570 V572 R602 L606 P612 L614	G569-F604 CarbonylContact C-O 3.56Å; G569-F604 WeakPolarHBondContact CA-O 3.5Å; L570-F604 PolarHBondContact N-O 2.89Å; L570-F604 PolarHBondContact O-N 2.85Å; V572-F604 HydrophobicContact CB-CD2 4.45Å; V572-F604 HydrophobicContact CB-CE2 4.01Å; V572-F604 HydrophobicContact CG2-CD2 3.78Å; V572-F604 HydrophobicContact CG2-CE2 3.69Å; R602-F604 HydrophobicContact CB-CE1 4.49Å; R602-F604 HydrophobicContact CB-CE2 3.84Å; R602-F604 HydrophobicContact CB-CZ 3.78Å; F604-L606 PolarHBondContact O-N 3.04Å; F604-P612 HydrophobicContact CB-CB 3.8Å; F604-P612 HydrophobicContact CB-CG 3.82Å; F604-P612 HydrophobicContact CD1-CB 3.33Å; F604-P612 HydrophobicContact CD1-CG 4.16Å; F604-P612 HydrophobicContact CD2-CB 3.8Å; F604-P612 HydrophobicContact CD2-CG 3.76Å; F604-P612 HydrophobicContact CE1-CB 3.7Å; F604-P612 HydrophobicContact CE2-CB 4.14Å; F604-P612 HydrophobicContact CE2-CG 4.31Å; F604-P612 HydrophobicContact CG-CB 3.36Å; F604-P612 HydrophobicContact CG-CG 3.66Å; F604-P612 HydrophobicContact CZ-CB 4.09Å; F604-L614 HydrophobicContact CE2-CD1 4.44Å
605	S	77.6	Confident	71.2	Confident	52 Å²	52	92.1 Å²	92.1	36%	0.364	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126.8	176.9	-178	0	0	0	0	111.4	S607	S605-S607 PolarHBondContact O-N 3.29Å; S605-S607 WeakPolarHBondContact OG-CB 3.42Å; S605-S607 PolarHBondContact OG-N 3.08Å; S605-S607 PolarHBondContact OG-OG 3.11Å
606	L	72.8	Confident	69.9	Low	72 Å²	72	94.9 Å²	94.9	38%	0.377	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-78.9	-6.5	177	-70.3	165.4	0	0	0	112.3	F567 S568 F604 T608 G609	F567-L606 HydrophobicContact CB-CD1 3.66Å; S568-L606 PolarHBondContact O-N 2.87Å; F604-L606 PolarHBondContact O-N 3.04Å; L606-T608 PolarHBondContact O-N 3.42Å; L606-T608 VanDerWaalsContact O-N 3.1Å; L606-G609 PolarHBondContact O-N 3.39Å; L606-G609 VanDerWaalsContact O-N 3.08Å
607	S	66.9	Low	68.7	Low	101 Å²	101	94.9 Å²	94.9	71%	0.706	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.8	-178.8	65	0	0	0	0	114.9	S605	S605-S607 PolarHBondContact O-N 3.29Å; S605-S607 WeakPolarHBondContact OG-CB 3.42Å; S605-S607 PolarHBondContact OG-N 3.08Å; S605-S607 PolarHBondContact OG-OG 3.11Å
608	T	61.8	Low	67.2	Low	94 Å²	94	92.3 Å²	92.3	58%	0.577	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-85.8	-6.5	-179.7	58.9	0	0	0	0	113.9	L606 K610	L606-T608 PolarHBondContact O-N 3.42Å; L606-T608 VanDerWaalsContact O-N 3.1Å; T608-K610 PolarHBondContact O-N 3.47Å
609	G	59.3	Low	65.6	Low	76 Å²	76	92 Å²	92	78%	0.784	48%	0.479	S	S	*	.			trans	65.2	5.3	-178.5	0	0	0	0	0	115.1	L606	L606-G609 PolarHBondContact O-N 3.39Å; L606-G609 VanDerWaalsContact O-N 3.08Å
610	K	57.8	Low	63.9	Low	163 Å²	163	89.2 Å²	89.2	71%	0.709	47%	0.473	S	S	*	.	S	Bend	trans	-102.1	134.8	178.8	-67.3	177.1	-178.2	178.6	0	109.5	T608	T608-K610 PolarHBondContact O-N 3.47Å
611	R	55.5	Low	61.9	Low	150 Å²	150	93.9 Å²	93.9	57%	0.566	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-60.5	132.5	168.5	-171.9	-175.8	-172.6	-176.3	6.1	108.3	I613 S761	R611-I613 PolarHBondContact O-N 3.13Å; R611-S761 PolarHBondContact NH1-O 2.92Å
612	P	58.2	Low	59.9	Low	23 Å²	23	97.3 Å²	97.3	15%	0.149	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-61.4	136.1	172.5	26.2	-34.3	0	0	0	110.1	L570 F604 L614	L570-P612 HydrophobicContact CD2-CG 4.23Å; F604-P612 HydrophobicContact CB-CB 3.8Å; F604-P612 HydrophobicContact CB-CG 3.82Å; F604-P612 HydrophobicContact CD1-CB 3.33Å; F604-P612 HydrophobicContact CD1-CG 4.16Å; F604-P612 HydrophobicContact CD2-CB 3.8Å; F604-P612 HydrophobicContact CD2-CG 3.76Å; F604-P612 HydrophobicContact CE1-CB 3.7Å; F604-P612 HydrophobicContact CE2-CB 4.14Å; F604-P612 HydrophobicContact CE2-CG 4.31Å; F604-P612 HydrophobicContact CG-CB 3.36Å; F604-P612 HydrophobicContact CG-CG 3.66Å; F604-P612 HydrophobicContact CZ-CB 4.09Å; P612-L614 HydrophobicContact CB-CD1 4.4Å; P612-L614 HydrophobicContact CG-CD1 4.16Å; P612-L614 PolarHBondContact O-N 2.76Å
613	I	59.4	Low	58.2	Low	149 Å²	149	100.7 Å²	100.7	76%	0.764	54%	0.54	S	S	*	.			trans	-79	102.8	173.7	-54.6	177.9	0	0	0	106.6	R611 D615	R611-I613 PolarHBondContact O-N 3.13Å; I613-D615 HydrophobicContact CG2-CB 4.11Å; I613-D615 PolarHBondContact O-N 3.48Å
614	L	58.2	Low	56	Low	84 Å²	84	101.3 Å²	101.3	44%	0.44	55%	0.551	S	S	.	*			trans	-74.2	80	165.5	-80.7	73.7	0	0	0	107.4	V572 Y574 F604 P612 L616	V572-L614 HydrophobicContact CG1-CD2 4.31Å; Y574-L614 HydrophobicContact CE1-CD2 4.31Å; F604-L614 HydrophobicContact CE2-CD1 4.44Å; P612-L614 HydrophobicContact CB-CD1 4.4Å; P612-L614 HydrophobicContact CG-CD1 4.16Å; P612-L614 PolarHBondContact O-N 2.76Å; L614-L616 PolarHBondContact O-N 2.75Å
615	D	50.3	Low	54.1	Low	67 Å²	67	104.2 Å²	104.2	36%	0.358	58%	0.577	S	S	.	*			trans	-76.2	117.1	178.9	-160.3	-13.6	0	0	0	110.3	I613 L617 L618	I613-D615 HydrophobicContact CG2-CB 4.11Å; I613-D615 PolarHBondContact O-N 3.48Å; D615-L617 VanDerWaalsContact C-N 3.28Å; D615-L617 VanDerWaalsContact OD1-CB 3.24Å; D615-L617 WeakPolarHBondContact OD1-CB 3.38Å; D615-L617 VanDerWaalsContact OD1-CG 3.26Å; D615-L617 WeakPolarHBondContact OD1-CG 3.41Å; D615-L617 PolarHBondContact OD1-N 2.98Å; D615-L618 HydrophobicContact CB-CD1 4.34Å; D615-L618 HydrophobicContact CB-CG 4.37Å
616	L	51.2	Low	52.6	Low	133 Å²	133	110.2 Å²	110.2	70%	0.696	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-82.5	-7.3	177.1	-70.4	164	0	0	0	112.2	L614 L618 Y619	L614-L616 PolarHBondContact O-N 2.75Å; L616-L618 VanDerWaalsContact C-N 3.28Å; L616-Y619 PolarHBondContact O-N 3.41Å
617	L	55.1	Low	51.1	Low	133 Å²	133	109.5 Å²	109.5	70%	0.696	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-73.8	-20.2	173.5	-58.5	174.2	0	0	0	112.2	D615 Y619 A620	D615-L617 VanDerWaalsContact C-N 3.28Å; D615-L617 VanDerWaalsContact OD1-CB 3.24Å; D615-L617 WeakPolarHBondContact OD1-CB 3.38Å; D615-L617 VanDerWaalsContact OD1-CG 3.26Å; D615-L617 WeakPolarHBondContact OD1-CG 3.41Å; D615-L617 PolarHBondContact OD1-N 2.98Å; L617-Y619 PolarHBondContact O-N 2.75Å; L617-A620 WeakPolarHBondContact O-CB 3.34Å; L617-A620 PolarHBondContact O-N 2.91Å
618	L	50.5	Low	49.7	Very low	105 Å²	105	112.8 Å²	112.8	55%	0.55	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-74	16.7	170.6	-61.5	174.2	0	0	0	113.7	D615 L616	D615-L618 HydrophobicContact CB-CD1 4.34Å; D615-L618 HydrophobicContact CB-CG 4.37Å; L616-L618 VanDerWaalsContact C-N 3.28Å
619	Y	50.1	Low	49	Very low	80 Å²	80	114.5 Å²	114.5	31%	0.314	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-137.6	42.7	172.3	-61.4	-84.6	0	0	0	108.5	R602 L616 L617 K647	R602-Y619 PolarHBondContact NH2-OH 2.82Å; L616-Y619 PolarHBondContact O-N 3.41Å; L617-Y619 PolarHBondContact O-N 2.75Å; Y619-K647 WeakPolarHBondContact O-CE 3.42Å; Y619-K647 PolarHBondContact O-NZ 3.47Å
620	A	47.2	Very low	47.9	Very low	40 Å²	40	116.1 Å²	116.1	33%	0.331	62%	0.618	S	S	.	*			trans	-137.8	49.6	179.3	0	0	0	0	0	109.3	L617	L617-A620 WeakPolarHBondContact O-CB 3.34Å; L617-A620 PolarHBondContact O-N 2.91Å
621	D	39.5	Very low	47	Very low	129 Å²	129	114.8 Å²	114.8	69%	0.69	62%	0.619	S	S	*	*			trans	-74.8	121.8	171.3	-50.5	-58.3	0	0	0	108.1	D623	D621-D623 PolarHBondContact O-N 3.24Å
622	D	43.8	Very low	46.6	Very low	156 Å²	156	112.4 Å²	112.4	83%	0.834	62%	0.623	S	S	*	*			trans	-86.3	11.5	-174.9	-69.4	-46.1	0	0	0	112.6	L624	D622-L624 VanDerWaalsContact C-N 3.26Å; D622-L624 PolarHBondContact O-N 3.28Å
623	D	44.5	Very low	45.7	Very low	154 Å²	154	119 Å²	119	82%	0.824	66%	0.657	S	S	*	*			trans	-81.1	14.8	-170.4	-72.1	-38.9	0	0	0	115.3	D621 S625	D621-D623 PolarHBondContact O-N 3.24Å; D623-S625 PolarHBondContact O-N 2.88Å
624	L	36.7	Very low	44.8	Very low	122 Å²	122	116.5 Å²	116.5	64%	0.639	65%	0.653	S	S	*	*	S	Bend	trans	-80	95	165.7	-71.7	-172.6	0	0	0	110	D622 D626 Y643	D622-L624 VanDerWaalsContact C-N 3.26Å; D622-L624 PolarHBondContact O-N 3.28Å; L624-D626 PolarHBondContact O-N 3.09Å; L624-D626 VanDerWaalsContact O-N 3.12Å; L624-Y643 HydrophobicContact CD1-CE1 4.06Å; L624-Y643 HydrophobicContact CD1-CE2 4.25Å
625	S	40.7	Very low	44.5	Very low	106 Å²	106	119.9 Å²	119.9	74%	0.741	67%	0.671	S	S	*	*			trans	-49	109.2	179.3	172.2	0	0	0	0	113.9	D623 G627	D623-S625 PolarHBondContact O-N 2.88Å; S625-G627 PolarHBondContact O-N 2.82Å
626	D	44.4	Very low	44.4	Very low	178 Å²	178	125.7 Å²	125.7	95%	0.952	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	59.4	174.3	-168.9	30.2	0	0	0	112.1	L624	L624-D626 PolarHBondContact O-N 3.09Å; L624-D626 VanDerWaalsContact O-N 3.12Å
627	G	41.1	Very low	44	Very low	57 Å²	57	126.9 Å²	126.9	59%	0.588	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.4	1.7	-163.8	0	0	0	0	0	117.6	S625	S625-G627 PolarHBondContact O-N 2.82Å
628	E	37.7	Very low	43.4	Very low	170 Å²	170	129.8 Å²	129.8	79%	0.794	71%	0.705	S	S	*	*			trans	-88.6	114.6	172.9	-166.7	164.8	-116.7	0	0	110.4	I630	E628-I630 PolarHBondContact O-N 2.99Å
629	V	47.4	Very low	43.1	Very low	129 Å²	129	130 Å²	130	78%	0.782	71%	0.707	S	S	*	*			trans	-78.9	105.2	178.7	179.2	0	0	0	0	108.8	D631	V629-D631 PolarHBondContact O-N 3.34Å
630	I	36.4	Very low	42.8	Very low	111 Å²	111	135.5 Å²	135.5	57%	0.569	73%	0.728	S	S	*	*			trans	-79.5	115.7	174.6	-58.9	174	0	0	0	108.8	E628	E628-I630 PolarHBondContact O-N 2.99Å
631	D	39.1	Very low	42.7	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	76%	0.755	S	S	*	*			trans	-63.9	132.2	170.2	-76.9	-47.9	0	0	0	110.4	V629 D633	V629-D631 PolarHBondContact O-N 3.34Å; D631-D633 PolarHBondContact O-N 3.29Å
632	P	46.8	Very low	43.1	Very low	100 Å²	100	144.1 Å²	144.1	65%	0.649	76%	0.763	S	S	*	*	S	Bend	trans	-84.6	2	-163.9	33.6	-38.3	0	0	0	116.1
633	D	39.7	Very low	42.9	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	75%	0.753	S	S	*	*			trans	-109.1	46	-170.1	-72.1	-40.9	0	0	0	113.3	D631	D631-D633 PolarHBondContact O-N 3.29Å
634	S	40.8	Very low	42.8	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	75%	0.749	S	S	*	*			trans	-141.6	36.3	174.5	-168.1	0	0	0	0	114.2	E636	S634-E636 PolarHBondContact O-N 3.16Å
635	D	51.2	Low	43	Very low	156 Å²	156	137.6 Å²	137.6	83%	0.834	73%	0.734	S	S	*	*			trans	-76.3	91.3	172.1	-82.3	-25.4	0	0	0	112
636	E	48.7	Very low	43.1	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	73%	0.729	S	S	*	*	S	Bend	trans	-158.2	-34.3	144	-120.4	168.4	-159.9	0	0	114.6	S634	S634-E636 PolarHBondContact O-N 3.16Å
637	D	42.9	Very low	43.1	Very low	158 Å²	158	134.5 Å²	134.5	85%	0.845	71%	0.713	S	S	*	*			trans	-113.7	14.9	-170.3	-84	-43.7	0	0	0	116.7	D639	D637-D639 VanDerWaalsContact C-N 3.33Å; D637-D639 PolarHBondContact O-N 2.94Å
638	R	42.2	Very low	43.3	Very low	193 Å²	193	135.5 Å²	135.5	73%	0.728	71%	0.711	S	S	*	*			trans	-75.9	83.5	170.3	-92.4	-174.8	169.3	-179.3	-4.2	111.7	Y640	R638-Y640 VanDerWaalsContact C-N 3.33Å; R638-Y640 PolarHBondContact O-N 3.3Å
639	D	44	Very low	44.1	Very low	110 Å²	110	130.2 Å²	130.2	59%	0.588	69%	0.688	S	S	*	*			trans	-71.1	77.1	-179.9	-133.9	4.2	0	0	0	112.2	D637 D641 K663	D637-D639 VanDerWaalsContact C-N 3.33Å; D637-D639 PolarHBondContact O-N 2.94Å; D639-D641 VanDerWaalsContact C-N 3.3Å; D639-D641 PolarHBondContact O-N 2.86Å; D639-K663 IonicContact OD1-NZ 3.76Å; D639-K663 PolarHBondContact OD1-NZ 2.93Å; D639-K663 IonicContact OD2-NZ 2.69Å; D639-K663 PolarHBondContact OD2-NZ 3.28Å
640	Y	43.8	Very low	44.4	Very low	196 Å²	196	128 Å²	128	77%	0.769	68%	0.676	S	S	*	*	S	Bend	trans	48	11.9	142.5	-112.4	-94.7	0	0	0	122.9	R638 E642	R638-Y640 VanDerWaalsContact C-N 3.33Å; R638-Y640 PolarHBondContact O-N 3.3Å; Y640-E642 PolarHBondContact O-N 3.11Å; Y640-E642 VanDerWaalsContact O-N 3.13Å
641	D	46	Very low	45.3	Very low	167 Å²	167	131.1 Å²	131.1	89%	0.893	68%	0.68	S	S	*	*			trans	-74	9.1	172.4	-84.6	-23.3	0	0	0	113.8	D639 Y643	D639-D641 VanDerWaalsContact C-N 3.3Å; D639-D641 PolarHBondContact O-N 2.86Å; D641-Y643 PolarHBondContact O-N 2.88Å
642	E	46.1	Very low	46.4	Very low	182 Å²	182	127 Å²	127	85%	0.85	66%	0.658	S	S	*	*	S	Bend	trans	-72.3	96.9	-178.8	-166.8	172.8	-175.9	0	0	112.5	Y640	Y640-E642 PolarHBondContact O-N 3.11Å; Y640-E642 VanDerWaalsContact O-N 3.13Å
643	Y	41.4	Very low	47.3	Very low	161 Å²	161	126.8 Å²	126.8	63%	0.631	65%	0.651	S	S	*	*			trans	57.7	72.9	153.3	-115.8	-109.8	0	0	0	116.7	L624 D641 S645	L624-Y643 HydrophobicContact CD1-CE1 4.06Å; L624-Y643 HydrophobicContact CD1-CE2 4.25Å; D641-Y643 PolarHBondContact O-N 2.88Å; Y643-S645 PolarHBondContact O-N 3.12Å
644	A	41.7	Very low	48.5	Very low	90 Å²	90	122.9 Å²	122.9	74%	0.744	63%	0.628	S	S	*	*			trans	-67	58.3	159	0	0	0	0	0	112.5	A646	A644-A646 PolarHBondContact O-N 2.86Å
645	S	40.2	Very low	49.9	Very low	44 Å²	44	125.8 Å²	125.8	31%	0.308	62%	0.624	S	S	.	*			trans	-54.6	133.7	179.2	-173.8	0	0	0	0	110.9	Y643 K647 S648	Y643-S645 PolarHBondContact O-N 3.12Å; S645-K647 PolarHBondContact O-N 2.84Å; S645-S648 CarbonylContact O-C 3.49Å; S645-S648 PolarHBondContact O-N 2.72Å
646	A	43.1	Very low	50.8	Low	78 Å²	78	123.2 Å²	123.2	65%	0.645	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-12.9	-175.5	0	0	0	0	0	115	A644	A644-A646 PolarHBondContact O-N 2.86Å
647	K	45.2	Very low	51.8	Low	141 Å²	141	115.3 Å²	115.3	61%	0.613	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-25.6	175.7	-68	163.1	-172.6	158.7	0	113.3	Y619 S645	Y619-K647 WeakPolarHBondContact O-CE 3.42Å; Y619-K647 PolarHBondContact O-NZ 3.47Å; S645-K647 PolarHBondContact O-N 2.84Å
648	S	45.8	Very low	53.1	Low	79 Å²	79	110.1 Å²	110.1	55%	0.552	54%	0.541	S	S	*	.			trans	-159.7	117.1	175.1	55.4	0	0	0	0	113.2	S645 P650	S645-S648 CarbonylContact O-C 3.49Å; S645-S648 PolarHBondContact O-N 2.72Å; S648-P650 WeakPolarHBondContact O-CD 3.47Å
649	I	53.1	Low	54.7	Low	58 Å²	58	107.9 Å²	107.9	30%	0.297	54%	0.536	S	S	.	.			trans	-70.4	123.2	156	-42.4	176.8	0	0	0	106.8	R577 L592 R651	R577-I649 HydrophobicContact CB-CD1 3.56Å; R577-I649 HydrophobicContact CB-CG1 3.99Å; R577-I649 HydrophobicContact CG-CD1 4.4Å; L592-I649 HydrophobicContact CD2-CD1 3.44Å; L592-I649 VanDerWaalsContact CD2-CD1 3.44Å; I649-R651 PolarHBondContact O-N 3.13Å
650	P	54.7	Low	56	Low	82 Å²	82	107.2 Å²	107.2	53%	0.532	53%	0.532	S	S	.	.			trans	-63.3	135.8	170.2	26.9	-33.1	0	0	0	109.4	S648 I652	S648-P650 WeakPolarHBondContact O-CD 3.47Å; P650-I652 PolarHBondContact O-N 2.91Å
651	R	55.2	Low	57.4	Low	177 Å²	177	99.6 Å²	99.6	67%	0.668	50%	0.504	S	S	*	.			trans	-68.6	100.7	178.4	-73.6	179.2	172	-120.8	-9.2	109.5	D589 I649 N653	D589-R651 IonicContact OD1-CZ 3.26Å; D589-R651 VanDerWaalsContact OD1-CZ 3.28Å; D589-R651 IonicContact OD1-NH1 2.85Å; D589-R651 PolarHBondContact OD1-NH1 3.36Å; D589-R651 IonicContact OD1-NH2 3.97Å; D589-R651 PolarHBondContact OD1-NH2 2.91Å; D589-R651 VanDerWaalsContact OD1-NH2 3.07Å; D589-R651 IonicContact OD2-CZ 2.67Å; D589-R651 IonicContact OD2-NH1 2.63Å; D589-R651 IonicContact OD2-NH2 3.29Å; D589-R651 PolarHBondContact OD2-NH2 2.99Å; I649-R651 PolarHBondContact O-N 3.13Å; R651-N653 PolarHBondContact O-N 2.76Å
652	I	61.7	Low	58.8	Low	49 Å²	49	97.8 Å²	97.8	25%	0.251	49%	0.488	S	S	.	.			trans	-60.7	107.2	176.5	-52.9	-172.9	0	0	0	109.1	I590 P650 H656 R657 L660	I590-I652 HydrophobicContact CD1-CB 4.34Å; P650-I652 PolarHBondContact O-N 2.91Å; I652-H656 HydrophobicContact CG2-CB 3.89Å; I652-R657 HydrophobicContact CG2-CB 3.9Å; I652-R657 HydrophobicContact CG2-CG 4.41Å; I652-R657 PolarHBondContact O-NE 2.69Å; I652-R657 PolarHBondContact O-NH2 2.83Å; I652-L660 HydrophobicContact CD1-CD2 4.31Å
653	N	65.8	Low	60	Low	94 Å²	94	94.8 Å²	94.8	50%	0.503	47%	0.473	S	S	.	.			trans	-54.5	144.9	178.3	-173.6	-11.9	0	0	0	110.1	R651 R655 H656 R657	R651-N653 PolarHBondContact O-N 2.76Å; N653-R655 VanDerWaalsContact C-N 3.27Å; N653-R655 PolarHBondContact O-N 3.34Å; N653-H656 CarbonylContact O-C 3.32Å; N653-H656 WeakPolarHBondContact O-CA 3.33Å; N653-H656 WeakPolarHBondContact O-CB 3.45Å; N653-H656 PolarHBondContact O-N 3.39Å; N653-R657 PolarHBondContact O-N 3.48Å
654	Q	64.9	Low	61.5	Low	79 Å²	79	90.9 Å²	90.9	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-51.8	-44	-177.6	-166.2	-170	31	0	0	112.1	V584 H656 R657 I658	V584-Q654 HydrophobicContact CG1-CG 4.37Å; Q654-H656 PolarHBondContact O-N 2.89Å; Q654-R657 PolarHBondContact O-N 3.39Å; Q654-I658 HydrophobicContact CG-CD1 4.15Å; Q654-I658 VanDerWaalsContact O-CG1 3.29Å; Q654-I658 WeakPolarHBondContact O-CG1 3.36Å; Q654-I658 PolarHBondContact O-N 2.58Å
655	R	70.6	Confident	63.1	Low	158 Å²	158	89.6 Å²	89.6	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-57.7	-44.5	175.2	-64.4	-172.2	-174.9	-176.8	4.5	111.7	D408 N653 K659	D408-R655 VanDerWaalsContact CG-NH2 3.33Å; D408-R655 IonicContact OD1-CZ 2.75Å; D408-R655 IonicContact OD1-NH2 3.53Å; D408-R655 PolarHBondContact OD1-NH2 3.49Å; D408-R655 IonicContact OD2-CZ 2.58Å; D408-R655 VanDerWaalsContact OD2-CZ 3.26Å; D408-R655 IonicContact OD2-NH1 2.77Å; D408-R655 PolarHBondContact OD2-NH1 2.88Å; D408-R655 IonicContact OD2-NH2 3.08Å; D408-R655 PolarHBondContact OD2-NH2 2.93Å; N653-R655 VanDerWaalsContact C-N 3.27Å; N653-R655 PolarHBondContact O-N 3.34Å; R655-K659 PolarHBondContact O-N 2.94Å; R655-K659 VanDerWaalsContact O-N 3.16Å
656	H	68.9	Low	64.7	Low	103 Å²	103	91 Å²	91	48%	0.477	47%	0.471	S	S	.	.	H	α-helix	trans	-71.3	-38.6	179	-69.8	-159.5	0	0	0	112.1	I652 N653 Q654 I658 K659 L660	I652-H656 HydrophobicContact CG2-CB 3.89Å; N653-H656 CarbonylContact O-C 3.32Å; N653-H656 WeakPolarHBondContact O-CA 3.33Å; N653-H656 WeakPolarHBondContact O-CB 3.45Å; N653-H656 PolarHBondContact O-N 3.39Å; Q654-H656 PolarHBondContact O-N 2.89Å; H656-I658 VanDerWaalsContact C-N 3.33Å; H656-I658 PolarHBondContact O-N 2.75Å; H656-K659 CarbonylContact O-C 3.43Å; H656-K659 WeakPolarHBondContact O-CB 3.37Å; H656-K659 PolarHBondContact O-N 2.93Å; H656-K659 VanDerWaalsContact O-N 3.13Å; H656-L660 WeakPolarHBondContact O-CB 3.23Å; H656-L660 PolarHBondContact O-N 3.12Å
657	R	70.7	Confident	66	Low	23 Å²	23	95.5 Å²	95.5	9%	0.087	48%	0.476	C	S	.	.	H	α-helix	trans	-63.4	-40	178.7	-159.9	-173.1	-57.9	162.7	15.1	111.5	Q579 V584 I652 N653 Q654 L660 L661	Q579-R657 VanDerWaalsContact NE2-NE 3.18Å; V584-R657 HydrophobicContact CG2-CG 4.22Å; I652-R657 HydrophobicContact CG2-CB 3.9Å; I652-R657 HydrophobicContact CG2-CG 4.41Å; I652-R657 PolarHBondContact O-NE 2.69Å; I652-R657 PolarHBondContact O-NH2 2.83Å; N653-R657 PolarHBondContact O-N 3.48Å; Q654-R657 PolarHBondContact O-N 3.39Å; R657-L660 PolarHBondContact O-N 2.86Å; R657-L661 WeakPolarHBondContact O-CB 3.38Å; R657-L661 WeakPolarHBondContact O-CG 3.2Å; R657-L661 PolarHBondContact O-N 3.27Å
658	I	70.4	Confident	67	Low	49 Å²	49	91 Å²	91	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-66.1	-40.7	172.7	-65.5	166.9	0	0	0	110.8	Q654 H656 K662 V668	Q654-I658 HydrophobicContact CG-CD1 4.15Å; Q654-I658 VanDerWaalsContact O-CG1 3.29Å; Q654-I658 WeakPolarHBondContact O-CG1 3.36Å; Q654-I658 PolarHBondContact O-N 2.58Å; H656-I658 VanDerWaalsContact C-N 3.33Å; H656-I658 PolarHBondContact O-N 2.75Å; I658-K662 HydrophobicContact CG2-CD 4.23Å; I658-K662 WeakPolarHBondContact O-CB 3.22Å; I658-K662 VanDerWaalsContact O-CG 3.31Å; I658-K662 WeakPolarHBondContact O-CG 3.28Å; I658-K662 PolarHBondContact O-N 2.9Å; I658-V668 HydrophobicContact CG1-CG1 4.31Å; I658-V668 HydrophobicContact CG2-CB 4.41Å; I658-V668 HydrophobicContact CG2-CG1 4.17Å
659	K	74.8	Confident	68	Low	146 Å²	146	93.1 Å²	93.1	64%	0.635	46%	0.461	S	S	*	.	H	α-helix	trans	-62.8	-42.1	174.8	-166.4	-179.5	-178.1	-174.1	0	111.7	R655 H656 K662 K663	R655-K659 PolarHBondContact O-N 2.94Å; R655-K659 VanDerWaalsContact O-N 3.16Å; H656-K659 CarbonylContact O-C 3.43Å; H656-K659 WeakPolarHBondContact O-CB 3.37Å; H656-K659 PolarHBondContact O-N 2.93Å; H656-K659 VanDerWaalsContact O-N 3.13Å; K659-K662 PolarHBondContact O-N 3.19Å; K659-K663 PolarHBondContact O-N 2.95Å
660	L	72.3	Confident	68.7	Low	96 Å²	96	99.8 Å²	99.8	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-48.9	177.7	-177.2	64.6	0	0	0	112	I652 H656 R657 K662 K663 S664	I652-L660 HydrophobicContact CD1-CD2 4.31Å; H656-L660 WeakPolarHBondContact O-CB 3.23Å; H656-L660 PolarHBondContact O-N 3.12Å; R657-L660 PolarHBondContact O-N 2.86Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 3.47Å; L660-K663 WeakPolarHBondContact O-CB 3.38Å; L660-K663 PolarHBondContact O-N 2.79Å; L660-K663 VanDerWaalsContact O-N 3.14Å; L660-S664 PolarHBondContact O-N 3.44Å; L660-S664 PolarHBondContact O-OG 2.69Å
661	L	72.9	Confident	69.5	Low	35 Å²	35	99.3 Å²	99.3	18%	0.183	48%	0.481	C	S	.	.	H	α-helix	trans	-59	-43.4	176.7	-74.8	169.1	0	0	0	111.5	V584 R657 S664 G665 V666 V668	V584-L661 HydrophobicContact CG2-CD1 3.52Å; R657-L661 WeakPolarHBondContact O-CB 3.38Å; R657-L661 WeakPolarHBondContact O-CG 3.2Å; R657-L661 PolarHBondContact O-N 3.27Å; L661-S664 WeakPolarHBondContact CA-OG 3.26Å; L661-S664 CarbonylContact O-C 3.54Å; L661-S664 PolarHBondContact O-N 2.86Å; L661-S664 PolarHBondContact O-OG 2.67Å; L661-G665 PolarHBondContact O-N 3.36Å; L661-V666 HydrophobicContact CB-CB 4.2Å; L661-V666 HydrophobicContact CD2-CB 4.33Å; L661-V666 HydrophobicContact CD2-CG1 4.41Å; L661-V666 HydrophobicContact CD2-CG2 4.22Å; L661-V666 WeakPolarHBondContact O-CB 3.47Å; L661-V666 PolarHBondContact O-N 2.84Å; L661-V668 HydrophobicContact CB-CG2 3.57Å; L661-V668 HydrophobicContact CD1-CG2 4.14Å
662	K	76	Confident	70.5	Confident	129 Å²	129	94.8 Å²	94.8	56%	0.561	47%	0.473	S	S	*	.	H	α-helix	trans	-64.5	-39.7	173.9	-72.6	-177.6	176.4	-166.8	0	113.1	I658 K659 L660 S664 G665 V668	I658-K662 HydrophobicContact CG2-CD 4.23Å; I658-K662 WeakPolarHBondContact O-CB 3.22Å; I658-K662 VanDerWaalsContact O-CG 3.31Å; I658-K662 WeakPolarHBondContact O-CG 3.28Å; I658-K662 PolarHBondContact O-N 2.9Å; K659-K662 PolarHBondContact O-N 3.19Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 3.47Å; K662-S664 VanDerWaalsContact C-N 3.26Å; K662-S664 PolarHBondContact O-N 2.77Å; K662-G665 PolarHBondContact O-N 2.85Å; K662-G665 VanDerWaalsContact O-N 3.09Å; K662-V668 HydrophobicContact CG-CB 4.45Å; K662-V668 HydrophobicContact CG-CG2 4.12Å
663	K	71.4	Confident	71.1	Confident	120 Å²	120	97.8 Å²	97.8	52%	0.522	49%	0.49	S	S	.	.	H	α-helix	trans	-56.6	-41.1	170.7	-89.5	-167.4	169.9	-172.3	0	110.9	D639 K659 L660 G665	D639-K663 IonicContact OD1-NZ 3.76Å; D639-K663 PolarHBondContact OD1-NZ 2.93Å; D639-K663 IonicContact OD2-NZ 2.69Å; D639-K663 PolarHBondContact OD2-NZ 3.28Å; K659-K663 PolarHBondContact O-N 2.95Å; L660-K663 WeakPolarHBondContact O-CB 3.38Å; L660-K663 PolarHBondContact O-N 2.79Å; L660-K663 VanDerWaalsContact O-N 3.14Å; K663-G665 PolarHBondContact O-N 3.45Å
664	S	72.9	Confident	71.5	Confident	79 Å²	79	95.7 Å²	95.7	55%	0.552	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	14.8	176.1	60	0	0	0	0	115.4	L660 L661 K662 V666	L660-S664 PolarHBondContact O-N 3.44Å; L660-S664 PolarHBondContact O-OG 2.69Å; L661-S664 WeakPolarHBondContact CA-OG 3.26Å; L661-S664 CarbonylContact O-C 3.54Å; L661-S664 PolarHBondContact O-N 2.86Å; L661-S664 PolarHBondContact O-OG 2.67Å; K662-S664 VanDerWaalsContact C-N 3.26Å; K662-S664 PolarHBondContact O-N 2.77Å; S664-V666 PolarHBondContact O-N 2.9Å
665	G	74.7	Confident	72	Confident	63 Å²	63	95.6 Å²	95.6	65%	0.649	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	2.2	178.7	0	0	0	0	0	115.5	L661 K662 K663 K667	L661-G665 PolarHBondContact O-N 3.36Å; K662-G665 PolarHBondContact O-N 2.85Å; K662-G665 VanDerWaalsContact O-N 3.09Å; K663-G665 PolarHBondContact O-N 3.45Å; G665-K667 PolarHBondContact O-N 3.47Å
666	V	73.9	Confident	72.3	Confident	72 Å²	72	91 Å²	91	44%	0.436	47%	0.474	S	S	.	.			trans	-72.4	119.3	178	-179.7	0	0	0	0	109.3	L661 S664 V668	L661-V666 HydrophobicContact CB-CB 4.2Å; L661-V666 HydrophobicContact CD2-CB 4.33Å; L661-V666 HydrophobicContact CD2-CG1 4.41Å; L661-V666 HydrophobicContact CD2-CG2 4.22Å; L661-V666 WeakPolarHBondContact O-CB 3.47Å; L661-V666 PolarHBondContact O-N 2.84Å; S664-V666 PolarHBondContact O-N 2.9Å; V666-V668 PolarHBondContact O-N 3.27Å
667	K	70.4	Confident	72.8	Confident	173 Å²	173	89.4 Å²	89.4	75%	0.752	48%	0.475	S	S	*	.			trans	-66.9	93.6	171.7	-69.1	-175	178.8	-179.4	0	110	G665 E669	G665-K667 PolarHBondContact O-N 3.47Å; K667-E669 HydrophobicContact CB-CG 4.23Å; K667-E669 PolarHBondContact O-N 3.2Å
668	V	66.7	Low	73.1	Confident	46 Å²	46	92.4 Å²	92.4	28%	0.279	49%	0.492	S	S	.	.			trans	-75.6	80.3	170.9	-172.7	0	0	0	0	109.1	I658 L661 K662 V666	I658-V668 HydrophobicContact CG1-CG1 4.31Å; I658-V668 HydrophobicContact CG2-CB 4.41Å; I658-V668 HydrophobicContact CG2-CG1 4.17Å; L661-V668 HydrophobicContact CB-CG2 3.57Å; L661-V668 HydrophobicContact CD1-CG2 4.14Å; K662-V668 HydrophobicContact CG-CB 4.45Å; K662-V668 HydrophobicContact CG-CG2 4.12Å; V666-V668 PolarHBondContact O-N 3.27Å
669	E	66.9	Low	73.4	Confident	124 Å²	124	96 Å²	96	58%	0.579	50%	0.502	S	S	*	.			trans	-77.8	132.7	176.3	-70.2	175.6	-164.5	0	0	110.5	K667 N671	K667-E669 HydrophobicContact CB-CG 4.23Å; K667-E669 PolarHBondContact O-N 3.2Å; E669-N671 PolarHBondContact O-N 2.95Å; E669-N671 VanDerWaalsContact O-N 3.15Å
670	K	67.7	Low	73.5	Confident	198 Å²	198	93.1 Å²	93.1	86%	0.861	49%	0.494	S	S	*	.			trans	-85.9	53.4	169.9	-68.5	-173.2	176.4	-175.5	0	110	T672	K670-T672 VanDerWaalsContact C-N 3.32Å; K670-T672 PolarHBondContact O-N 3.2Å
671	N	71.8	Confident	73.9	Confident	72 Å²	72	92.2 Å²	92.2	39%	0.385	49%	0.492	S	S	.	.			trans	-77.6	87.3	176.1	-169.5	-25.4	0	0	0	108.6	E669 D673 A674 I675	E669-N671 PolarHBondContact O-N 2.95Å; E669-N671 VanDerWaalsContact O-N 3.15Å; N671-D673 VanDerWaalsContact C-N 3.26Å; N671-D673 PolarHBondContact O-N 3.3Å; N671-D673 PolarHBondContact OD1-N 3.21Å; N671-A674 HydrophobicContact CB-CB 4.1Å; N671-A674 VanDerWaalsContact CG-CB 3.44Å; N671-A674 WeakPolarHBondContact OD1-CB 3.48Å; N671-A674 PolarHBondContact OD1-N 3.09Å; N671-I675 WeakPolarHBondContact O-CD1 3.36Å; N671-I675 VanDerWaalsContact O-CG1 3.29Å; N671-I675 WeakPolarHBondContact O-CG1 3.41Å; N671-I675 PolarHBondContact O-N 3.22Å
672	T	74.3	Confident	73.9	Confident	82 Å²	82	97.8 Å²	97.8	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-51.9	-49.7	176.1	34.8	0	0	0	0	110.4	K670 A674 I675 D676	K670-T672 VanDerWaalsContact C-N 3.32Å; K670-T672 PolarHBondContact O-N 3.2Å; T672-A674 VanDerWaalsContact C-N 3.33Å; T672-A674 PolarHBondContact O-N 3.4Å; T672-I675 CarbonylContact O-C 3.59Å; T672-I675 WeakPolarHBondContact O-CA 3.37Å; T672-I675 WeakPolarHBondContact O-CB 3.41Å; T672-I675 PolarHBondContact O-N 3.32Å; T672-D676 WeakPolarHBondContact O-CB 3.36Å; T672-D676 PolarHBondContact O-N 2.98Å
673	D	74.9	Confident	73.6	Confident	112 Å²	112	94.4 Å²	94.4	60%	0.599	50%	0.501	S	S	*	.	H	α-helix	trans	-68.7	-35	-167.2	-45.4	-1.4	0	0	0	110.9	N671 S677	N671-D673 VanDerWaalsContact C-N 3.26Å; N671-D673 PolarHBondContact O-N 3.3Å; N671-D673 PolarHBondContact OD1-N 3.21Å; D673-S677 VanDerWaalsContact O-CB 3.3Å; D673-S677 WeakPolarHBondContact O-CB 3.47Å; D673-S677 PolarHBondContact O-N 2.75Å; D673-S677 PolarHBondContact O-OG 3.4Å
674	A	75.3	Confident	73.6	Confident	50 Å²	50	95 Å²	95	41%	0.413	51%	0.506	S	S	.	.	H	α-helix	trans	-72.1	-34.2	171	0	0	0	0	0	113.1	N671 T672 L678	N671-A674 HydrophobicContact CB-CB 4.1Å; N671-A674 VanDerWaalsContact CG-CB 3.44Å; N671-A674 WeakPolarHBondContact OD1-CB 3.48Å; N671-A674 PolarHBondContact OD1-N 3.09Å; T672-A674 VanDerWaalsContact C-N 3.33Å; T672-A674 PolarHBondContact O-N 3.4Å; A674-L678 WeakPolarHBondContact O-CB 3.39Å; A674-L678 PolarHBondContact O-N 2.97Å
675	I	74.4	Confident	73.9	Confident	78 Å²	78	95.1 Å²	95.1	40%	0.4	51%	0.505	S	S	.	.	H	α-helix	trans	-70.9	-37.6	174.6	-66.6	165.7	0	0	0	110.5	N671 T672 L678 R679	N671-I675 WeakPolarHBondContact O-CD1 3.36Å; N671-I675 VanDerWaalsContact O-CG1 3.29Å; N671-I675 WeakPolarHBondContact O-CG1 3.41Å; N671-I675 PolarHBondContact O-N 3.22Å; T672-I675 CarbonylContact O-C 3.59Å; T672-I675 WeakPolarHBondContact O-CA 3.37Å; T672-I675 WeakPolarHBondContact O-CB 3.41Å; T672-I675 PolarHBondContact O-N 3.32Å; I675-L678 CarbonylContact O-C 3.5Å; I675-L678 PolarHBondContact O-N 3.14Å; I675-R679 WeakPolarHBondContact O-CG 3.49Å; I675-R679 PolarHBondContact O-N 3.39Å
676	D	77.3	Confident	74.5	Confident	62 Å²	62	93.1 Å²	93.1	33%	0.332	49%	0.485	S	S	.	.	H	α-helix	trans	-73.2	-37.5	176.5	-69.6	-43	0	0	0	111.3	T672 L678 R679 N680	T672-D676 WeakPolarHBondContact O-CB 3.36Å; T672-D676 PolarHBondContact O-N 2.98Å; D676-L678 VanDerWaalsContact C-N 3.29Å; D676-L678 PolarHBondContact O-N 2.87Å; D676-R679 WeakPolarHBondContact O-CA 3.42Å; D676-R679 WeakPolarHBondContact O-CB 3.33Å; D676-R679 PolarHBondContact O-N 3.04Å; D676-R679 WeakPolarHBondContact OD1-CD 3.26Å; D676-R679 IonicContact OD1-CZ 3.65Å; D676-R679 IonicContact OD1-NE 3.9Å; D676-R679 IonicContact OD1-NH1 2.65Å; D676-R679 PolarHBondContact OD1-NH1 3.24Å; D676-N680 VanDerWaalsContact O-CG 3.23Å; D676-N680 PolarHBondContact O-N 3.47Å; D676-N680 PolarHBondContact O-OD1 2.87Å
677	S	80.2	Confident	75.3	Confident	69 Å²	69	89.8 Å²	89.8	48%	0.483	47%	0.465	S	S	.	.	H	α-helix	trans	-58.7	-39.8	166.1	-58.8	0	0	0	0	112	D673 R679 N680 T681	D673-S677 VanDerWaalsContact O-CB 3.3Å; D673-S677 WeakPolarHBondContact O-CB 3.47Å; D673-S677 PolarHBondContact O-N 2.75Å; D673-S677 PolarHBondContact O-OG 3.4Å; S677-R679 VanDerWaalsContact C-N 3.3Å; S677-R679 PolarHBondContact O-N 3.26Å; S677-N680 PolarHBondContact O-N 3.18Å; S677-T681 WeakPolarHBondContact O-CG2 3.27Å; S677-T681 PolarHBondContact O-N 3.4Å; S677-T681 PolarHBondContact O-OG1 3.36Å
678	L	75.8	Confident	76.2	Confident	86 Å²	86	86.9 Å²	86.9	45%	0.45	47%	0.466	S	S	.	.	H	α-helix	trans	-71.9	-20.9	175	-173.7	61.3	0	0	0	113.3	A674 I675 D676 T681 R682	A674-L678 WeakPolarHBondContact O-CB 3.39Å; A674-L678 PolarHBondContact O-N 2.97Å; I675-L678 CarbonylContact O-C 3.5Å; I675-L678 PolarHBondContact O-N 3.14Å; D676-L678 VanDerWaalsContact C-N 3.29Å; D676-L678 PolarHBondContact O-N 2.87Å; L678-T681 WeakPolarHBondContact CA-OG1 3.29Å; L678-T681 PolarHBondContact O-OG1 2.97Å; L678-R682 WeakPolarHBondContact O-CD 3.43Å; L678-R682 WeakPolarHBondContact O-CG 3.4Å
679	R	77.1	Confident	77.4	Confident	125 Å²	125	85.4 Å²	85.4	47%	0.472	46%	0.457	S	S	.	.	H	α-helix	trans	-78.5	-47	169.7	-72.9	162.6	174.3	150.8	-1	110.4	I675 D676 S677 R682 V683	I675-R679 WeakPolarHBondContact O-CG 3.49Å; I675-R679 PolarHBondContact O-N 3.39Å; D676-R679 WeakPolarHBondContact O-CA 3.42Å; D676-R679 WeakPolarHBondContact O-CB 3.33Å; D676-R679 PolarHBondContact O-N 3.04Å; D676-R679 WeakPolarHBondContact OD1-CD 3.26Å; D676-R679 IonicContact OD1-CZ 3.65Å; D676-R679 IonicContact OD1-NE 3.9Å; D676-R679 IonicContact OD1-NH1 2.65Å; D676-R679 PolarHBondContact OD1-NH1 3.24Å; S677-R679 VanDerWaalsContact C-N 3.3Å; S677-R679 PolarHBondContact O-N 3.26Å; R679-R682 CarbonylContact O-C 3.59Å; R679-R682 WeakPolarHBondContact O-CA 3.47Å; R679-R682 WeakPolarHBondContact O-CB 3.45Å; R679-R682 PolarHBondContact O-N 3.44Å; R679-V683 PolarHBondContact O-N 3.23Å
680	N	77.9	Confident	78.4	Confident	85 Å²	85	87.6 Å²	87.6	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-48.3	179.7	-66.1	-1.4	0	0	0	111.3	D676 S677 R682 V683 E684	D676-N680 VanDerWaalsContact O-CG 3.23Å; D676-N680 PolarHBondContact O-N 3.47Å; D676-N680 PolarHBondContact O-OD1 2.87Å; S677-N680 PolarHBondContact O-N 3.18Å; N680-R682 PolarHBondContact O-N 2.83Å; N680-V683 CarbonylContact O-C 3.58Å; N680-V683 WeakPolarHBondContact O-CA 3.44Å; N680-V683 WeakPolarHBondContact O-CB 3.42Å; N680-V683 PolarHBondContact O-N 3.15Å; N680-E684 WeakPolarHBondContact O-CB 3.31Å; N680-E684 VanDerWaalsContact O-CG 3.3Å; N680-E684 WeakPolarHBondContact O-CG 3.4Å; N680-E684 PolarHBondContact O-N 3.42Å
681	T	79.1	Confident	79.3	Confident	76 Å²	76	84.8 Å²	84.8	47%	0.466	46%	0.462	S	S	.	.	H	α-helix	trans	-61.1	-17.5	174.1	48.7	0	0	0	0	114.5	S677 L678 C685	S677-T681 WeakPolarHBondContact O-CG2 3.27Å; S677-T681 PolarHBondContact O-N 3.4Å; S677-T681 PolarHBondContact O-OG1 3.36Å; L678-T681 WeakPolarHBondContact CA-OG1 3.29Å; L678-T681 PolarHBondContact O-OG1 2.97Å; T681-C685 WeakPolarHBondContact O-CB 3.41Å
682	R	72.4	Confident	80	Confident	153 Å²	153	81.3 Å²	81.3	58%	0.577	44%	0.444	S	S	*	.	H	α-helix	trans	-93.7	-13.3	172	-68.5	173.2	-175.6	-174.1	0.2	113.8	L678 R679 N680 C685	L678-R682 WeakPolarHBondContact O-CD 3.43Å; L678-R682 WeakPolarHBondContact O-CG 3.4Å; R679-R682 CarbonylContact O-C 3.59Å; R679-R682 WeakPolarHBondContact O-CA 3.47Å; R679-R682 WeakPolarHBondContact O-CB 3.45Å; R679-R682 PolarHBondContact O-N 3.44Å; N680-R682 PolarHBondContact O-N 2.83Å; R682-C685 PolarHBondContact O-SG 2.96Å
683	V	70.9	Confident	80.9	Confident	58 Å²	58	80.7 Å²	80.7	35%	0.352	44%	0.44	S	S	.	.	H	α-helix	trans	-87.9	-37.4	169.7	164.3	0	0	0	0	110.2	R679 N680 C685 Q718 P719	R679-V683 PolarHBondContact O-N 3.23Å; N680-V683 CarbonylContact O-C 3.58Å; N680-V683 WeakPolarHBondContact O-CA 3.44Å; N680-V683 WeakPolarHBondContact O-CB 3.42Å; N680-V683 PolarHBondContact O-N 3.15Å; V683-C685 VanDerWaalsContact C-N 3.32Å; V683-C685 PolarHBondContact O-N 3.43Å; V683-Q718 VanDerWaalsContact CG1-CD 3.44Å; V683-Q718 HydrophobicContact CG1-CG 4.1Å; V683-P719 WeakPolarHBondContact O-CA 3.45Å; V683-P719 WeakPolarHBondContact O-CB 3.39Å
684	E	71.9	Confident	81.8	Confident	133 Å²	133	75.4 Å²	75.4	62%	0.621	41%	0.411	S	S	*	.	S	Bend	trans	-77	-11.3	179.4	-67.9	158	-167.3	0	0	113.6	N680 G686	N680-E684 WeakPolarHBondContact O-CB 3.31Å; N680-E684 VanDerWaalsContact O-CG 3.3Å; N680-E684 WeakPolarHBondContact O-CG 3.4Å; N680-E684 PolarHBondContact O-N 3.42Å; E684-G686 PolarHBondContact O-N 2.92Å
685	C	77.6	Confident	82.7	Confident	81 Å²	81	77 Å²	77	55%	0.547	41%	0.412	S	S	.	.	S	Bend	trans	-79.4	55.4	-174.2	69.6	0	0	0	0	114.8	T681 R682 V683 P719	T681-C685 WeakPolarHBondContact O-CB 3.41Å; R682-C685 PolarHBondContact O-SG 2.96Å; V683-C685 VanDerWaalsContact C-N 3.32Å; V683-C685 PolarHBondContact O-N 3.43Å; C685-P719 WeakPolarHBondContact O-CB 3.46Å
686	G	87.5	Confident	83.6	Confident	21 Å²	21	75.5 Å²	75.5	22%	0.216	41%	0.408	C	S	.	.	S	Bend	trans	-163.9	-175.7	179.4	0	0	0	0	0	113.3	E684 P719	E684-G686 PolarHBondContact O-N 2.92Å; G686-P719 WeakPolarHBondContact CA-O 3.48Å
687	C	90.9	Very high	84.3	Confident	2 Å²	2	80.4 Å²	80.4	1%	0.014	43%	0.429	C	S	.	.			trans	-83.5	123.3	-176.7	66.3	0	0	0	0	112.7	C689 C699 C701 C720 A721	C687-C689 VanDerWaalsContact CB-SG 3.57Å; C687-C689 PolarHBondContact O-N 3.37Å; C687-C699 WeakPolarHBondContact CB-SG 3.47Å; C687-C701 HydrophobicContact CB-CB 4.44Å; C687-C720 PolarHBondContact N-SG 3.38Å; C687-C720 VanDerWaalsContact N-SG 3.44Å; C687-C720 VanDerWaalsContact SG-CB 3.58Å; C687-A721 PolarHBondContact O-N 3.29Å
688	S	90.6	Very high	85	Confident	112 Å²	112	81.7 Å²	81.7	78%	0.783	43%	0.434	S	S	*	.			trans	-80.4	39.4	175.1	57.9	0	0	0	0	113.3	E690	S688-E690 PolarHBondContact O-N 2.84Å
689	C	91.4	Very high	85.8	Confident	14 Å²	14	77.6 Å²	77.6	10%	0.095	41%	0.412	C	S	.	.			trans	-61.3	122.4	-170.6	-65.5	0	0	0	0	112.9	C687 N691 G692 V693 C694 C722	C687-C689 VanDerWaalsContact CB-SG 3.57Å; C687-C689 PolarHBondContact O-N 3.37Å; C689-N691 PolarHBondContact O-N 3.3Å; C689-G692 WeakPolarHBondContact O-CA 3.29Å; C689-G692 PolarHBondContact O-N 2.84Å; C689-V693 WeakPolarHBondContact CB-O 3.41Å; C689-C694 HydrophobicContact CB-CB 4.14Å; C689-C722 HydrophobicContact CB-CB 4.48Å
690	E	87.6	Confident	86.6	Confident	170 Å²	170	76.4 Å²	76.4	79%	0.794	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-55.4	134.4	-176.5	-64.7	-174.2	173.4	0	0	112.1	S688 G692 V693	S688-E690 PolarHBondContact O-N 2.84Å; E690-G692 PolarHBondContact O-N 2.94Å; E690-V693 PolarHBondContact O-N 3.07Å
691	N	86.2	Confident	87.4	Confident	139 Å²	139	72.6 Å²	72.6	74%	0.743	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	48.2	26.1	-175.9	-61.2	-0.8	0	0	0	113.9	C689 V693 F723	C689-N691 PolarHBondContact O-N 3.3Å; N691-V693 PolarHBondContact O-N 2.67Å; N691-F723 VanDerWaalsContact O-CE2 3.25Å; N691-F723 WeakPolarHBondContact O-CE2 3.35Å
692	G	87	Confident	88.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	68.8	9.6	-176.2	0	0	0	0	0	115.4	C689 E690 A721 C722 F723 T726	C689-G692 WeakPolarHBondContact O-CA 3.29Å; C689-G692 PolarHBondContact O-N 2.84Å; E690-G692 PolarHBondContact O-N 2.94Å; G692-A721 WeakPolarHBondContact CA-O 3.46Å; G692-C722 WeakPolarHBondContact O-CA 3.49Å; G692-F723 PolarHBondContact O-N 2.71Å; G692-F723 VanDerWaalsContact O-N 3.08Å; G692-T726 PolarHBondContact O-OG1 3.06Å
693	V	92.2	Very high	89.2	Confident	69 Å²	69	67.1 Å²	67.1	42%	0.418	37%	0.372	S	S	.	.			trans	-89.1	106.5	179.6	-176.3	0	0	0	0	109.7	C689 E690 N691 L695 T726	C689-V693 WeakPolarHBondContact CB-O 3.41Å; E690-V693 PolarHBondContact O-N 3.07Å; N691-V693 PolarHBondContact O-N 2.67Å; V693-L695 HydrophobicContact CG1-CD2 4.28Å; V693-T726 HydrophobicContact CG2-CG2 4.46Å
694	C	94.8	Very high	90.3	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-100.2	115.8	-178.5	153.7	0	0	0	0	110	C689 C699 C722 T726 C727 T728	C689-C694 HydrophobicContact CB-CB 4.14Å; C694-C699 HydrophobicContact CB-CB 4.42Å; C694-C699 VanDerWaalsContact SG-CB 3.55Å; C694-C699 PolarHBondContact SG-SG 2.79Å; C694-C722 HydrophobicContact CB-CB 3.62Å; C694-T726 PolarHBondContact N-O 3.15Å; C694-C727 HydrophobicContact CB-CB 4.3Å; C694-C727 PolarHBondContact SG-SG 3.41Å; C694-T728 PolarHBondContact O-N 2.94Å; C694-T728 PolarHBondContact O-OG1 3.22Å
695	L	93.5	Very high	91.3	Very high	83 Å²	83	64.8 Å²	64.8	44%	0.435	37%	0.373	S	S	.	.			trans	-104.6	152.2	174.8	-55.2	176.5	0	0	0	110.3	V693 E697 T698 C699 T728	V693-L695 HydrophobicContact CG1-CD2 4.28Å; L695-E697 VanDerWaalsContact C-N 3.34Å; L695-E697 PolarHBondContact O-N 3.44Å; L695-T698 PolarHBondContact O-N 2.86Å; L695-C699 WeakPolarHBondContact O-CB 3.4Å; L695-C699 PolarHBondContact O-N 3.2Å; L695-T728 WeakPolarHBondContact CA-OG1 3.38Å
696	P	93.8	Very high	92.1	Very high	48 Å²	48	65.1 Å²	65.1	31%	0.312	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-40	-176.6	-20.3	33.2	0	0	0	112.8	T698 A702 T728	P696-T698 VanDerWaalsContact C-N 3.35Å; P696-T698 PolarHBondContact O-N 3.49Å; P696-A702 WeakPolarHBondContact O-CB 3.35Å; P696-T728 WeakPolarHBondContact CD-OG1 3.5Å
697	E	92.8	Very high	92.4	Very high	164 Å²	164	68.6 Å²	68.6	77%	0.766	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.5	-172.9	-44.8	-57.6	142.4	0	0	114	L695	L695-E697 VanDerWaalsContact C-N 3.34Å; L695-E697 PolarHBondContact O-N 3.44Å
698	T	93.6	Very high	92.5	Very high	96 Å²	96	68.5 Å²	68.5	59%	0.589	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	-13.3	-175.1	66.5	0	0	0	0	114.1	L695 P696 Q700	L695-T698 PolarHBondContact O-N 2.86Å; P696-T698 VanDerWaalsContact C-N 3.35Å; P696-T698 PolarHBondContact O-N 3.49Å; T698-Q700 PolarHBondContact O-N 2.98Å
699	C	94.3	Very high	92.5	Very high	0 Å²	0	66 Å²	66	0%	0	35%	0.354	C	S	.	.			trans	-80.9	116.5	175.1	176.3	0	0	0	0	110.1	C687 C694 L695 C701 A702 I703 C708	C687-C699 WeakPolarHBondContact CB-SG 3.47Å; C694-C699 HydrophobicContact CB-CB 4.42Å; C694-C699 VanDerWaalsContact SG-CB 3.55Å; C694-C699 PolarHBondContact SG-SG 2.79Å; L695-C699 WeakPolarHBondContact O-CB 3.4Å; L695-C699 PolarHBondContact O-N 3.2Å; C699-C701 PolarHBondContact O-N 3.28Å; C699-C701 VanDerWaalsContact O-N 3.17Å; C699-A702 HydrophobicContact CB-CB 3.9Å; C699-A702 WeakPolarHBondContact O-CA 3.1Å; C699-A702 WeakPolarHBondContact O-CB 3.29Å; C699-A702 PolarHBondContact O-N 3.26Å; C699-I703 WeakPolarHBondContact O-CG1 3.44Å; C699-I703 PolarHBondContact O-N 3.5Å; C699-C708 VanDerWaalsContact SG-SG 3.62Å
700	Q	93.2	Very high	92.3	Very high	100 Å²	100	65.4 Å²	65.4	47%	0.467	35%	0.35	S	S	.	.	H	α-helix	trans	-47.9	-46	177.3	-171.3	59.4	45.9	0	0	112.7	T698 A702 I703 D704	T698-Q700 PolarHBondContact O-N 2.98Å; Q700-A702 VanDerWaalsContact C-N 3.34Å; Q700-A702 PolarHBondContact O-N 2.9Å; Q700-I703 PolarHBondContact O-N 3.29Å; Q700-D704 WeakPolarHBondContact CG-OD2 3.39Å; Q700-D704 PolarHBondContact NE2-OD1 2.97Å; Q700-D704 VanDerWaalsContact NE2-OD1 3.1Å; Q700-D704 PolarHBondContact NE2-OD2 3.26Å; Q700-D704 WeakPolarHBondContact O-CB 3.19Å; Q700-D704 VanDerWaalsContact O-CG 3.29Å; Q700-D704 PolarHBondContact O-N 2.63Å
701	C	94.3	Very high	92.1	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.034	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-37.4	177.6	-59.1	0	0	0	0	113.4	C687 C699 G705 I706 C720	C687-C701 HydrophobicContact CB-CB 4.44Å; C699-C701 PolarHBondContact O-N 3.28Å; C699-C701 VanDerWaalsContact O-N 3.17Å; C701-G705 PolarHBondContact O-N 2.81Å; C701-I706 CarbonylContact C-O 3.43Å; C701-I706 HydrophobicContact CB-CD1 4.45Å; C701-I706 HydrophobicContact CB-CG1 3.92Å; C701-I706 WeakPolarHBondContact O-CG1 3.42Å; C701-I706 PolarHBondContact O-N 3.36Å; C701-C720 VanDerWaalsContact SG-SG 3.64Å
702	A	94.5	Very high	91.4	Very high	14 Å²	14	56.5 Å²	56.5	12%	0.116	32%	0.32	C	S	.	.	H	α-helix	trans	-72.2	-38.7	177.6	0	0	0	0	0	111.8	P696 C699 Q700 G705 N729	P696-A702 WeakPolarHBondContact O-CB 3.35Å; C699-A702 HydrophobicContact CB-CB 3.9Å; C699-A702 WeakPolarHBondContact O-CA 3.1Å; C699-A702 WeakPolarHBondContact O-CB 3.29Å; C699-A702 PolarHBondContact O-N 3.26Å; Q700-A702 VanDerWaalsContact C-N 3.34Å; Q700-A702 PolarHBondContact O-N 2.9Å; A702-G705 PolarHBondContact O-N 3.1Å; A702-N729 HydrophobicContact CB-CB 4.17Å
703	I	94.4	Very high	90.4	Very high	101 Å²	101	60.5 Å²	60.5	52%	0.518	36%	0.361	S	S	.	.	H	α-helix	trans	-63	-42.9	174.5	-64.1	164.4	0	0	0	110.5	C699 Q700 G705	C699-I703 WeakPolarHBondContact O-CG1 3.44Å; C699-I703 PolarHBondContact O-N 3.5Å; Q700-I703 PolarHBondContact O-N 3.29Å; I703-G705 PolarHBondContact O-N 2.88Å
704	D	93.6	Very high	89.6	Confident	95 Å²	95	65.6 Å²	65.6	51%	0.508	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.4	178	-67.4	-30.2	0	0	0	113.8	Q700 I706	Q700-D704 WeakPolarHBondContact CG-OD2 3.39Å; Q700-D704 PolarHBondContact NE2-OD1 2.97Å; Q700-D704 VanDerWaalsContact NE2-OD1 3.1Å; Q700-D704 PolarHBondContact NE2-OD2 3.26Å; Q700-D704 WeakPolarHBondContact O-CB 3.19Å; Q700-D704 VanDerWaalsContact O-CG 3.29Å; Q700-D704 PolarHBondContact O-N 2.63Å; D704-I706 HydrophobicContact CB-CG1 4.21Å
705	G	93.3	Very high	88.5	Confident	46 Å²	46	72.4 Å²	72.4	47%	0.474	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	35	179	0	0	0	0	0	114.2	C701 A702 I703	C701-G705 PolarHBondContact O-N 2.81Å; A702-G705 PolarHBondContact O-N 3.1Å; I703-G705 PolarHBondContact O-N 2.88Å
706	I	94.3	Very high	87.6	Confident	88 Å²	88	72.3 Å²	72.3	45%	0.451	41%	0.411	S	S	.	.			trans	-125.3	151.3	179.4	62	172.3	0	0	0	112.1	C701 D704 N729	C701-I706 CarbonylContact C-O 3.43Å; C701-I706 HydrophobicContact CB-CD1 4.45Å; C701-I706 HydrophobicContact CB-CG1 3.92Å; C701-I706 WeakPolarHBondContact O-CG1 3.42Å; C701-I706 PolarHBondContact O-N 3.36Å; D704-I706 HydrophobicContact CB-CG1 4.21Å; I706-N729 PolarHBondContact O-ND2 2.92Å
707	H	93.8	Very high	87	Confident	94 Å²	94	70.7 Å²	70.7	44%	0.435	40%	0.4	S	S	.	.			trans	-64.8	141.3	175.7	52.7	44.9	0	0	0	112	Q709 G732 T734	H707-Q709 PolarHBondContact O-N 2.9Å; H707-G732 WeakPolarHBondContact CA-O 3.35Å; H707-T734 HydrophobicContact CB-CG2 4.13Å; H707-T734 PolarHBondContact ND1-OG1 2.93Å
708	C	93.6	Very high	86.5	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	103.4	172.1	-69.6	0	0	0	0	110.3	C699 C720 N729 G732 R733 T734	C699-C708 VanDerWaalsContact SG-SG 3.62Å; C708-C720 HydrophobicContact CB-CB 4.37Å; C708-N729 PolarHBondContact N-ND2 2.65Å; C708-N729 PolarHBondContact SG-ND2 2.87Å; C708-G732 PolarHBondContact N-O 3.42Å; C708-R733 HydrophobicContact CB-CB 4.38Å; C708-R733 HydrophobicContact CB-CG 4.13Å; C708-R733 CarbonylContact O-C 3.5Å; C708-R733 WeakPolarHBondContact O-CA 3.49Å; C708-R733 WeakPolarHBondContact O-CG 3.48Å; C708-T734 PolarHBondContact O-N 2.8Å; C708-T734 VanDerWaalsContact O-O 3.11Å
709	Q	90.6	Very high	86.1	Confident	59 Å²	59	64.1 Å²	64.1	28%	0.276	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.5	177	-177.1	64.4	34	0	0	111.5	H707 D711 P719 C720 T734	H707-Q709 PolarHBondContact O-N 2.9Å; Q709-D711 PolarHBondContact NE2-OD1 3.01Å; Q709-P719 HydrophobicContact CB-CG 4.47Å; Q709-P719 WeakPolarHBondContact O-CD 3.36Å; Q709-C720 WeakPolarHBondContact O-CB 3.22Å; Q709-C720 PolarHBondContact O-N 3.16Å; Q709-C720 PolarHBondContact O-SG 2.92Å; Q709-T734 WeakPolarHBondContact CA-OG1 3.05Å; Q709-T734 VanDerWaalsContact OE1-CB 3.25Å; Q709-T734 PolarHBondContact OE1-OG1 3.32Å
710	V	88.2	Confident	86	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.018	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	110.7	-179.1	170.5	0	0	0	0	111.6	T717 C720 R733 T734 F735 Y736	V710-T717 HydrophobicContact CG1-CG2 3.69Å; V710-C720 HydrophobicContact CG2-CB 3.83Å; V710-C720 WeakPolarHBondContact CG2-O 3.44Å; V710-R733 HydrophobicContact CG2-CG 4.46Å; V710-T734 PolarHBondContact N-O 2.83Å; V710-F735 HydrophobicContact CB-CB 4.29Å; V710-F735 CarbonylContact O-C 3.59Å; V710-F735 WeakPolarHBondContact O-CA 3.24Å; V710-F735 VanDerWaalsContact O-CB 3.3Å; V710-F735 WeakPolarHBondContact O-CB 3.46Å; V710-Y736 PolarHBondContact O-N 3.17Å; V710-Y736 VanDerWaalsContact O-N 3.09Å
711	D	83.3	Confident	85.8	Confident	71 Å²	71	60.3 Å²	60.3	38%	0.38	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.6	174	-59.2	-22.9	0	0	0	109.7	Q709 Q718 Y736	Q709-D711 PolarHBondContact NE2-OD1 3.01Å; D711-Q718 WeakPolarHBondContact CA-O 3.21Å; D711-Q718 PolarHBondContact N-O 3.46Å; D711-Y736 WeakPolarHBondContact OD1-CB 3.45Å
712	G	71.4	Confident	85.7	Confident	51 Å²	51	60 Å²	60	53%	0.526	35%	0.349	S	S	.	.			trans	92.1	159.5	-174.1	0	0	0	0	0	114.2
713	G	66.1	Low	85.4	Confident	84 Å²	84	63.4 Å²	63.4	87%	0.866	36%	0.361	S	S	*	.	S	Bend	trans	-114.3	-4.3	-174.2	0	0	0	0	0	115.5
714	E	73.9	Confident	85.1	Confident	176 Å²	176	61.3 Å²	61.3	82%	0.822	36%	0.359	S	S	*	.	S	Bend	trans	-110	149.6	176.7	-68.5	177.8	-163.1	0	0	109.5	P716 T717	E714-P716 CarbonylContact O-C 3.33Å; E714-T717 WeakPolarHBondContact O-CG2 3.39Å
715	W	73.3	Confident	84.8	Confident	142 Å²	142	65.4 Å²	65.4	54%	0.538	38%	0.375	S	S	.	.	S	Bend	trans	-97.6	140.1	-176.8	-173.5	90.1	0	0	0	111.1	A721 F723	W715-A721 PolarHBondContact NE1-O 3.2Å; W715-A721 VanDerWaalsContact NE1-O 3.12Å; W715-F723 HydrophobicContact CB-CE1 3.97Å; W715-F723 AromaticContact CD1-CD1 3.93Å; W715-F723 AromaticContact CD1-CE1 3.18Å; W715-F723 AromaticContact CD1-CZ 3.5Å; W715-F723 VanDerWaalsContact CD1-CZ 3.5Å; W715-F723 HydrophobicContact CD2-CE1 4.41Å; W715-F723 HydrophobicContact CD2-CZ 4.2Å; W715-F723 AromaticContact CG-CE1 3.58Å; W715-F723 HydrophobicContact CG-CE1 3.58Å; W715-F723 AromaticContact CG-CZ 3.84Å; W715-F723 HydrophobicContact CG-CZ 3.84Å; W715-F723 AromaticContact NE1-CE1 3.82Å; W715-F723 AromaticContact NE1-CZ 3.66Å
716	P	73.6	Confident	84.8	Confident	81 Å²	81	65.5 Å²	65.5	53%	0.526	37%	0.366	S	S	.	.	S	Bend	cis	-72.5	126.9	3.8	29.5	-35.5	0	0	0	113.2	E714	E714-P716 CarbonylContact O-C 3.33Å
717	T	80.6	Confident	84.7	Confident	15 Å²	15	62.5 Å²	62.5	9%	0.092	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-71.9	149.5	174.2	47.5	0	0	0	0	110.7	V710 E714 C720	V710-T717 HydrophobicContact CG1-CG2 3.69Å; E714-T717 WeakPolarHBondContact O-CG2 3.39Å; T717-C720 CarbonylContact C-O 3.48Å; T717-C720 WeakPolarHBondContact CB-O 3.45Å; T717-C720 CarbonylContact O-C 3.57Å; T717-C720 PolarHBondContact OG1-O 3.13Å
718	Q	81.9	Confident	84.8	Confident	97 Å²	97	61.5 Å²	61.5	45%	0.453	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.8	-176.8	-65.2	178.4	-8.4	0	0	110.1	V683 D711	V683-Q718 VanDerWaalsContact CG1-CD 3.44Å; V683-Q718 HydrophobicContact CG1-CG 4.1Å; D711-Q718 WeakPolarHBondContact CA-O 3.21Å; D711-Q718 PolarHBondContact N-O 3.46Å
719	P	86.3	Confident	84.8	Confident	24 Å²	24	62 Å²	62	16%	0.156	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	cis	-77.6	-16.7	-6.2	33.3	-37	0	0	0	113.8	V683 C685 G686 Q709	V683-P719 WeakPolarHBondContact O-CA 3.45Å; V683-P719 WeakPolarHBondContact O-CB 3.39Å; C685-P719 WeakPolarHBondContact O-CB 3.46Å; G686-P719 WeakPolarHBondContact CA-O 3.48Å; Q709-P719 HydrophobicContact CB-CG 4.47Å; Q709-P719 WeakPolarHBondContact O-CD 3.36Å
720	C	91.3	Very high	85	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.007	36%	0.362	C	S	.	.			trans	-94.6	128.3	176.2	-60.4	0	0	0	0	112.5	C687 C701 C708 Q709 V710 T717 C722	C687-C720 PolarHBondContact N-SG 3.38Å; C687-C720 VanDerWaalsContact N-SG 3.44Å; C687-C720 VanDerWaalsContact SG-CB 3.58Å; C701-C720 VanDerWaalsContact SG-SG 3.64Å; C708-C720 HydrophobicContact CB-CB 4.37Å; Q709-C720 WeakPolarHBondContact O-CB 3.22Å; Q709-C720 PolarHBondContact O-N 3.16Å; Q709-C720 PolarHBondContact O-SG 2.92Å; V710-C720 HydrophobicContact CG2-CB 3.83Å; V710-C720 WeakPolarHBondContact CG2-O 3.44Å; T717-C720 CarbonylContact C-O 3.48Å; T717-C720 WeakPolarHBondContact CB-O 3.45Å; T717-C720 CarbonylContact O-C 3.57Å; T717-C720 PolarHBondContact OG1-O 3.13Å; C720-C722 VanDerWaalsContact C-N 3.27Å; C720-C722 PolarHBondContact O-N 3.49Å
721	A	89.8	Confident	85.2	Confident	19 Å²	19	66.9 Å²	66.9	16%	0.157	38%	0.384	C	S	.	.			trans	-79.4	-0.6	-179.1	0	0	0	0	0	114.8	C687 G692 W715	C687-A721 PolarHBondContact O-N 3.29Å; G692-A721 WeakPolarHBondContact CA-O 3.46Å; W715-A721 PolarHBondContact NE1-O 3.2Å; W715-A721 VanDerWaalsContact NE1-O 3.12Å
722	C	91.6	Very high	85.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	38%	0.379	C	S	.	.			trans	-77.8	135.4	-173.7	63.4	0	0	0	0	113.7	C689 G692 C694 C720 C727 R733	C689-C722 HydrophobicContact CB-CB 4.48Å; G692-C722 WeakPolarHBondContact O-CA 3.49Å; C694-C722 HydrophobicContact CB-CB 3.62Å; C720-C722 VanDerWaalsContact C-N 3.27Å; C720-C722 PolarHBondContact O-N 3.49Å; C722-C727 HydrophobicContact CB-CB 4.42Å; C722-R733 PolarHBondContact O-NE 3.08Å; C722-R733 VanDerWaalsContact O-NE 3.12Å; C722-R733 PolarHBondContact O-NH2 3.26Å
723	F	89.1	Confident	86.6	Confident	85 Å²	85	65.6 Å²	65.6	37%	0.373	37%	0.366	S	S	.	.			trans	-70.5	168	173.4	-58.5	-65.9	0	0	0	112.1	N691 G692 W715 T726 C727 R733	N691-F723 VanDerWaalsContact O-CE2 3.25Å; N691-F723 WeakPolarHBondContact O-CE2 3.35Å; G692-F723 PolarHBondContact O-N 2.71Å; G692-F723 VanDerWaalsContact O-N 3.08Å; W715-F723 HydrophobicContact CB-CE1 3.97Å; W715-F723 AromaticContact CD1-CD1 3.93Å; W715-F723 AromaticContact CD1-CE1 3.18Å; W715-F723 AromaticContact CD1-CZ 3.5Å; W715-F723 VanDerWaalsContact CD1-CZ 3.5Å; W715-F723 HydrophobicContact CD2-CE1 4.41Å; W715-F723 HydrophobicContact CD2-CZ 4.2Å; W715-F723 AromaticContact CG-CE1 3.58Å; W715-F723 HydrophobicContact CG-CE1 3.58Å; W715-F723 AromaticContact CG-CZ 3.84Å; W715-F723 HydrophobicContact CG-CZ 3.84Å; W715-F723 AromaticContact NE1-CE1 3.82Å; W715-F723 AromaticContact NE1-CZ 3.66Å; F723-T726 WeakPolarHBondContact CB-OG1 3.48Å; F723-C727 VanDerWaalsContact O-CB 3.24Å; F723-C727 WeakPolarHBondContact O-CB 3.18Å; F723-C727 PolarHBondContact O-N 3.45Å; F723-R733 PolarHBondContact O-NE 3.46Å; F723-R733 VanDerWaalsContact O-NE 3.14Å
724	A	87.9	Confident	87.7	Confident	57 Å²	57	63.8 Å²	63.8	47%	0.471	34%	0.339	S	S	.	.	S	Bend	trans	-68.2	-50.9	176	0	0	0	0	0	111.8	T726	A724-T726 VanDerWaalsContact C-N 3.31Å; A724-T726 PolarHBondContact O-N 2.94Å
725	E	88.1	Confident	88.4	Confident	181 Å²	181	61.3 Å²	61.3	85%	0.846	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.6	-174.2	-49.3	-52.6	140.2	0	0	114
726	T	91.9	Very high	88.9	Confident	48 Å²	48	60.2 Å²	60.2	29%	0.294	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	17.5	-175.9	58.2	0	0	0	0	113.3	G692 V693 C694 F723 A724	G692-T726 PolarHBondContact O-OG1 3.06Å; V693-T726 HydrophobicContact CG2-CG2 4.46Å; C694-T726 PolarHBondContact N-O 3.15Å; F723-T726 WeakPolarHBondContact CB-OG1 3.48Å; A724-T726 VanDerWaalsContact C-N 3.31Å; A724-T726 PolarHBondContact O-N 2.94Å
727	C	93.4	Very high	89.4	Confident	24 Å²	24	59.1 Å²	59.1	16%	0.162	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-96.3	114.9	172.2	-175.6	0	0	0	0	110.8	C694 C722 F723 R733	C694-C727 HydrophobicContact CB-CB 4.3Å; C694-C727 PolarHBondContact SG-SG 3.41Å; C722-C727 HydrophobicContact CB-CB 4.42Å; F723-C727 VanDerWaalsContact O-CB 3.24Å; F723-C727 WeakPolarHBondContact O-CB 3.18Å; F723-C727 PolarHBondContact O-N 3.45Å; C727-R733 HydrophobicContact CB-CB 4.4Å; C727-R733 HydrophobicContact CB-CG 4.48Å
728	T	94.9	Very high	89.6	Confident	74 Å²	74	62.4 Å²	62.4	45%	0.454	33%	0.333	S	S	.	.			trans	-111.8	16.9	179.8	63.9	0	0	0	0	113.3	C694 L695 P696	C694-T728 PolarHBondContact O-N 2.94Å; C694-T728 PolarHBondContact O-OG1 3.22Å; L695-T728 WeakPolarHBondContact CA-OG1 3.38Å; P696-T728 WeakPolarHBondContact CD-OG1 3.5Å
729	N	94.7	Very high	89.7	Confident	9 Å²	9	65 Å²	65	5%	0.048	35%	0.345	C	S	.	.			trans	-53.4	123.3	172	-179.5	-14.7	0	0	0	110.3	A702 I706 C708 E731 G732	A702-N729 HydrophobicContact CB-CB 4.17Å; I706-N729 PolarHBondContact O-ND2 2.92Å; C708-N729 PolarHBondContact N-ND2 2.65Å; C708-N729 PolarHBondContact SG-ND2 2.87Å; N729-E731 VanDerWaalsContact C-N 3.3Å; N729-E731 PolarHBondContact O-N 2.75Å; N729-E731 PolarHBondContact OD1-N 3.36Å; N729-G732 PolarHBondContact ND2-O 3.04Å; N729-G732 WeakPolarHBondContact O-CA 3.4Å; N729-G732 PolarHBondContact O-N 2.88Å
730	P	93.2	Very high	89.7	Confident	63 Å²	63	66.1 Å²	66.1	41%	0.409	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.6	-178.8	26.5	-35.3	0	0	0	113.8	G732	P730-G732 PolarHBondContact O-N 2.85Å
731	E	93.9	Very high	89.5	Confident	103 Å²	103	69.2 Å²	69.2	48%	0.481	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.4	173.6	-57.4	-53.4	135.6	0	0	112.3	N729	N729-E731 VanDerWaalsContact C-N 3.3Å; N729-E731 PolarHBondContact O-N 2.75Å; N729-E731 PolarHBondContact OD1-N 3.36Å
732	G	91.9	Very high	89.3	Confident	27 Å²	27	72.9 Å²	72.9	28%	0.278	39%	0.389	S	S	.	.			trans	89.4	-170.1	169.6	0	0	0	0	0	115.2	H707 C708 N729 P730	H707-G732 WeakPolarHBondContact CA-O 3.35Å; C708-G732 PolarHBondContact N-O 3.42Å; N729-G732 PolarHBondContact ND2-O 3.04Å; N729-G732 WeakPolarHBondContact O-CA 3.4Å; N729-G732 PolarHBondContact O-N 2.88Å; P730-G732 PolarHBondContact O-N 2.85Å
733	R	91.3	Very high	89.3	Confident	67 Å²	67	77.4 Å²	77.4	25%	0.253	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	121.2	-178.6	-171.8	-174.6	-175.1	-87.4	9.4	109.3	C708 V710 C722 F723 C727	C708-R733 HydrophobicContact CB-CB 4.38Å; C708-R733 HydrophobicContact CB-CG 4.13Å; C708-R733 CarbonylContact O-C 3.5Å; C708-R733 WeakPolarHBondContact O-CA 3.49Å; C708-R733 WeakPolarHBondContact O-CG 3.48Å; V710-R733 HydrophobicContact CG2-CG 4.46Å; C722-R733 PolarHBondContact O-NE 3.08Å; C722-R733 VanDerWaalsContact O-NE 3.12Å; C722-R733 PolarHBondContact O-NH2 3.26Å; F723-R733 PolarHBondContact O-NE 3.46Å; F723-R733 VanDerWaalsContact O-NE 3.14Å; C727-R733 HydrophobicContact CB-CB 4.4Å; C727-R733 HydrophobicContact CB-CG 4.48Å
734	T	89.9	Confident	89.1	Confident	47 Å²	47	79.6 Å²	79.6	29%	0.288	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	141.8	175.2	42.6	0	0	0	0	109	H707 C708 Q709 V710	H707-T734 HydrophobicContact CB-CG2 4.13Å; H707-T734 PolarHBondContact ND1-OG1 2.93Å; C708-T734 PolarHBondContact O-N 2.8Å; C708-T734 VanDerWaalsContact O-O 3.11Å; Q709-T734 WeakPolarHBondContact CA-OG1 3.05Å; Q709-T734 VanDerWaalsContact OE1-CB 3.25Å; Q709-T734 PolarHBondContact OE1-OG1 3.32Å; V710-T734 PolarHBondContact N-O 2.83Å
735	F	87.6	Confident	89.1	Confident	124 Å²	124	84.2 Å²	84.2	54%	0.544	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.4	175.4	85.5	-82.6	0	0	0	112.6	V710 D737	V710-F735 HydrophobicContact CB-CB 4.29Å; V710-F735 CarbonylContact O-C 3.59Å; V710-F735 WeakPolarHBondContact O-CA 3.24Å; V710-F735 VanDerWaalsContact O-CB 3.3Å; V710-F735 WeakPolarHBondContact O-CB 3.46Å; F735-D737 HydrophobicContact CD2-CB 4.45Å; F735-D737 HydrophobicContact CE2-CB 3.68Å; F735-D737 HydrophobicContact CZ-CB 3.94Å; F735-D737 PolarHBondContact O-N 3.26Å
736	Y	85	Confident	89	Confident	119 Å²	119	80.1 Å²	80.1	47%	0.467	41%	0.406	S	S	.	.			trans	-80	107.5	174.3	-179.8	-98.2	0	0	0	111.2	V710 D711 P738 V741	V710-Y736 PolarHBondContact O-N 3.17Å; V710-Y736 VanDerWaalsContact O-N 3.09Å; D711-Y736 WeakPolarHBondContact OD1-CB 3.45Å; Y736-P738 HydrophobicContact CE1-CB 3.88Å; Y736-P738 VanDerWaalsContact O-CD 3.29Å; Y736-P738 WeakPolarHBondContact O-CD 3.3Å; Y736-V741 HydrophobicContact CE2-CB 4.5Å; Y736-V741 HydrophobicContact CE2-CG2 3.89Å
737	D	83.8	Confident	88.8	Confident	58 Å²	58	83.6 Å²	83.6	31%	0.31	41%	0.413	S	S	.	.			trans	-90.5	105.6	172.2	-176.5	-19.7	0	0	0	110.7	F735 E739 A740 V741	F735-D737 HydrophobicContact CD2-CB 4.45Å; F735-D737 HydrophobicContact CE2-CB 3.68Å; F735-D737 HydrophobicContact CZ-CB 3.94Å; F735-D737 PolarHBondContact O-N 3.26Å; D737-E739 VanDerWaalsContact C-N 3.3Å; D737-E739 PolarHBondContact O-N 3.27Å; D737-E739 WeakPolarHBondContact OD1-CA 3.44Å; D737-E739 PolarHBondContact OD1-N 3.24Å; D737-A740 HydrophobicContact CB-CB 3.91Å; D737-A740 VanDerWaalsContact CG-CB 3.41Å; D737-A740 PolarHBondContact OD1-N 3.46Å; D737-A740 VanDerWaalsContact OD2-CB 3.27Å; D737-A740 WeakPolarHBondContact OD2-CB 3.3Å; D737-V741 WeakPolarHBondContact O-CB 3.37Å; D737-V741 VanDerWaalsContact O-CG2 3.26Å; D737-V741 WeakPolarHBondContact O-CG2 3.41Å; D737-V741 PolarHBondContact O-N 3.43Å; D737-V741 VanDerWaalsContact O-N 3.15Å
738	P	83.6	Confident	88.4	Confident	83 Å²	83	85.5 Å²	85.5	54%	0.539	42%	0.424	S	S	.	.	H	α-helix	trans	-67.7	-28.4	179.1	28.3	-34.9	0	0	0	113	Y736 H742	Y736-P738 HydrophobicContact CE1-CB 3.88Å; Y736-P738 VanDerWaalsContact O-CD 3.29Å; Y736-P738 WeakPolarHBondContact O-CD 3.3Å; P738-H742 WeakPolarHBondContact O-CB 3.4Å; P738-H742 PolarHBondContact O-N 3.38Å
739	E	84.9	Confident	87.9	Confident	152 Å²	152	84.6 Å²	84.6	71%	0.71	42%	0.416	S	S	*	.	H	α-helix	trans	-79.3	-43.9	-177.7	-174.1	161.7	-140.5	0	0	110.9	D737 V741 H742 E743	D737-E739 VanDerWaalsContact C-N 3.3Å; D737-E739 PolarHBondContact O-N 3.27Å; D737-E739 WeakPolarHBondContact OD1-CA 3.44Å; D737-E739 PolarHBondContact OD1-N 3.24Å; E739-V741 VanDerWaalsContact C-N 3.33Å; E739-V741 PolarHBondContact O-N 2.98Å; E739-H742 PolarHBondContact O-N 3.29Å; E739-E743 WeakPolarHBondContact O-CB 3.42Å; E739-E743 PolarHBondContact O-N 3.47Å
740	A	86.1	Confident	87.3	Confident	47 Å²	47	89.5 Å²	89.5	39%	0.388	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-39.7	172.3	0	0	0	0	0	112.2	D737 E743 F744	D737-A740 HydrophobicContact CB-CB 3.91Å; D737-A740 VanDerWaalsContact CG-CB 3.41Å; D737-A740 PolarHBondContact OD1-N 3.46Å; D737-A740 VanDerWaalsContact OD2-CB 3.27Å; D737-A740 WeakPolarHBondContact OD2-CB 3.3Å; A740-E743 PolarHBondContact O-N 3.46Å; A740-F744 WeakPolarHBondContact O-CB 3.49Å; A740-F744 PolarHBondContact O-N 2.82Å
741	V	86.8	Confident	86.7	Confident	67 Å²	67	90.4 Å²	90.4	41%	0.406	44%	0.442	S	S	.	.	H	α-helix	trans	-64.9	-41.4	173.9	169.8	0	0	0	0	111.2	Y736 D737 E739 R745	Y736-V741 HydrophobicContact CE2-CB 4.5Å; Y736-V741 HydrophobicContact CE2-CG2 3.89Å; D737-V741 WeakPolarHBondContact O-CB 3.37Å; D737-V741 VanDerWaalsContact O-CG2 3.26Å; D737-V741 WeakPolarHBondContact O-CG2 3.41Å; D737-V741 PolarHBondContact O-N 3.43Å; D737-V741 VanDerWaalsContact O-N 3.15Å; E739-V741 VanDerWaalsContact C-N 3.33Å; E739-V741 PolarHBondContact O-N 2.98Å; V741-R745 VanDerWaalsContact O-CB 3.29Å; V741-R745 WeakPolarHBondContact O-CB 3.45Å; V741-R745 PolarHBondContact O-N 3.45Å
742	H	85.7	Confident	86.1	Confident	95 Å²	95	93 Å²	93	44%	0.44	45%	0.447	S	S	.	.	H	α-helix	trans	-65.3	-44.6	176.1	-179.4	-144	0	0	0	112.2	P738 E739 R745 Q746	P738-H742 WeakPolarHBondContact O-CB 3.4Å; P738-H742 PolarHBondContact O-N 3.38Å; E739-H742 PolarHBondContact O-N 3.29Å; H742-R745 WeakPolarHBondContact O-CB 3.29Å; H742-R745 PolarHBondContact O-N 3.44Å; H742-Q746 PolarHBondContact CE1-NE2 3.15Å; H742-Q746 PolarHBondContact NE2-NE2 3.39Å; H742-Q746 WeakPolarHBondContact O-CG 3.43Å; H742-Q746 PolarHBondContact O-N 3.17Å
743	E	91.4	Very high	85.5	Confident	95 Å²	95	98 Å²	98	44%	0.444	46%	0.457	S	S	.	.	H	α-helix	trans	-66.4	-42.8	178.1	-159.5	-132.5	-170.9	0	0	111.3	E739 A740 R745 Q746 R747	E739-E743 WeakPolarHBondContact O-CB 3.42Å; E739-E743 PolarHBondContact O-N 3.47Å; A740-E743 PolarHBondContact O-N 3.46Å; E743-R745 VanDerWaalsContact C-N 3.33Å; E743-R745 PolarHBondContact O-N 2.9Å; E743-Q746 PolarHBondContact O-N 2.99Å; E743-R747 VanDerWaalsContact O-CB 3.28Å; E743-R747 WeakPolarHBondContact O-CB 3.46Å; E743-R747 PolarHBondContact O-N 3.05Å; E743-R747 IonicContact OE1-CZ 3.2Å; E743-R747 IonicContact OE1-NH1 2.69Å; E743-R747 IonicContact OE1-NH2 3.86Å; E743-R747 PolarHBondContact OE1-NH2 2.68Å; E743-R747 IonicContact OE2-CZ 3.31Å; E743-R747 IonicContact OE2-NH1 3.88Å; E743-R747 PolarHBondContact OE2-NH1 2.94Å; E743-R747 IonicContact OE2-NH2 2.77Å; E743-R747 PolarHBondContact OE2-NH2 2.92Å
744	F	84.8	Confident	84.7	Confident	131 Å²	131	97 Å²	97	58%	0.575	46%	0.464	S	S	*	.	H	α-helix	trans	-58.9	-43.2	172	178	-94.8	0	0	0	111.8	A740 R747 T748	A740-F744 WeakPolarHBondContact O-CB 3.49Å; A740-F744 PolarHBondContact O-N 2.82Å; F744-R747 PolarHBondContact O-N 3.05Å; F744-T748 VanDerWaalsContact O-CB 3.22Å; F744-T748 WeakPolarHBondContact O-CB 3.39Å; F744-T748 PolarHBondContact O-N 3.49Å; F744-T748 PolarHBondContact O-OG1 3.47Å
745	R	87.4	Confident	83.8	Confident	155 Å²	155	95.9 Å²	95.9	59%	0.585	46%	0.458	S	S	*	.	H	α-helix	trans	-62.5	-45.5	175.5	-179.8	176.1	178.9	-93.4	5.3	111.6	V741 H742 E743 T748 I749	V741-R745 VanDerWaalsContact O-CB 3.29Å; V741-R745 WeakPolarHBondContact O-CB 3.45Å; V741-R745 PolarHBondContact O-N 3.45Å; H742-R745 WeakPolarHBondContact O-CB 3.29Å; H742-R745 PolarHBondContact O-N 3.44Å; E743-R745 VanDerWaalsContact C-N 3.33Å; E743-R745 PolarHBondContact O-N 2.9Å; R745-T748 PolarHBondContact O-N 3.19Å; R745-I749 HydrophobicContact CG-CD1 3.9Å; R745-I749 WeakPolarHBondContact O-CB 3.42Å; R745-I749 VanDerWaalsContact O-CG1 3.26Å; R745-I749 WeakPolarHBondContact O-CG1 3.36Å; R745-I749 PolarHBondContact O-N 3.34Å
746	Q	87.9	Confident	83.1	Confident	95 Å²	95	96.1 Å²	96.1	44%	0.444	46%	0.461	S	S	.	.	H	α-helix	trans	-61	-51	175.5	-71.5	-170.6	27.9	0	0	111.6	H742 E743 T748 I749 M750	H742-Q746 PolarHBondContact CE1-NE2 3.15Å; H742-Q746 PolarHBondContact NE2-NE2 3.39Å; H742-Q746 WeakPolarHBondContact O-CG 3.43Å; H742-Q746 PolarHBondContact O-N 3.17Å; E743-Q746 PolarHBondContact O-N 2.99Å; Q746-T748 VanDerWaalsContact C-N 3.3Å; Q746-T748 PolarHBondContact O-N 2.73Å; Q746-I749 PolarHBondContact O-N 3.48Å; Q746-M750 WeakPolarHBondContact O-CG 3.3Å; Q746-M750 PolarHBondContact O-N 2.86Å
747	R	85.7	Confident	82.5	Confident	120 Å²	120	99 Å²	99	45%	0.453	48%	0.476	S	S	.	.	H	α-helix	trans	-56.8	-43.3	178.1	-174.1	-176	-73.8	120.6	-5.8	111.4	E743 F744 M750 N751	E743-R747 VanDerWaalsContact O-CB 3.28Å; E743-R747 WeakPolarHBondContact O-CB 3.46Å; E743-R747 PolarHBondContact O-N 3.05Å; E743-R747 IonicContact OE1-CZ 3.2Å; E743-R747 IonicContact OE1-NH1 2.69Å; E743-R747 IonicContact OE1-NH2 3.86Å; E743-R747 PolarHBondContact OE1-NH2 2.68Å; E743-R747 IonicContact OE2-CZ 3.31Å; E743-R747 IonicContact OE2-NH1 3.88Å; E743-R747 PolarHBondContact OE2-NH1 2.94Å; E743-R747 IonicContact OE2-NH2 2.77Å; E743-R747 PolarHBondContact OE2-NH2 2.92Å; F744-R747 PolarHBondContact O-N 3.05Å; R747-M750 PolarHBondContact O-N 3.01Å; R747-N751 WeakPolarHBondContact O-CB 3.42Å; R747-N751 PolarHBondContact O-N 3.05Å
748	T	85.4	Confident	82	Confident	64 Å²	64	100.5 Å²	100.5	39%	0.393	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-43.9	177.3	-61.7	0	0	0	0	112	F744 R745 Q746 M750 N751 W752	F744-T748 VanDerWaalsContact O-CB 3.22Å; F744-T748 WeakPolarHBondContact O-CB 3.39Å; F744-T748 PolarHBondContact O-N 3.49Å; F744-T748 PolarHBondContact O-OG1 3.47Å; R745-T748 PolarHBondContact O-N 3.19Å; Q746-T748 VanDerWaalsContact C-N 3.3Å; Q746-T748 PolarHBondContact O-N 2.73Å; T748-M750 PolarHBondContact O-N 3.3Å; T748-N751 PolarHBondContact O-N 3.21Å; T748-W752 WeakPolarHBondContact O-CB 3.5Å; T748-W752 PolarHBondContact O-N 3.09Å
749	I	85.6	Confident	80.8	Confident	55 Å²	55	100 Å²	100	28%	0.282	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-40.5	175.4	-70.7	166.4	0	0	0	111.2	R745 Q746 R753	R745-I749 HydrophobicContact CG-CD1 3.9Å; R745-I749 WeakPolarHBondContact O-CB 3.42Å; R745-I749 VanDerWaalsContact O-CG1 3.26Å; R745-I749 WeakPolarHBondContact O-CG1 3.36Å; R745-I749 PolarHBondContact O-N 3.34Å; Q746-I749 PolarHBondContact O-N 3.48Å; I749-R753 WeakPolarHBondContact O-CB 3.42Å; I749-R753 VanDerWaalsContact O-CG 3.23Å; I749-R753 WeakPolarHBondContact O-CG 3.32Å; I749-R753 PolarHBondContact O-N 3.14Å
750	M	81.6	Confident	79.6	Confident	113 Å²	113	98.6 Å²	98.6	56%	0.557	49%	0.494	S	S	*	.	H	α-helix	trans	-67.2	-44	176.5	-67.5	-57.1	-164.9	0	0	111.9	Q746 R747 T748 W752 R753 A754	Q746-M750 WeakPolarHBondContact O-CG 3.3Å; Q746-M750 PolarHBondContact O-N 2.86Å; R747-M750 PolarHBondContact O-N 3.01Å; T748-M750 PolarHBondContact O-N 3.3Å; M750-W752 PolarHBondContact O-N 2.77Å; M750-R753 PolarHBondContact O-N 3.07Å; M750-A754 WeakPolarHBondContact O-CB 3.37Å; M750-A754 PolarHBondContact O-N 3.11Å
751	N	81	Confident	77.8	Confident	82 Å²	82	100.5 Å²	100.5	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-42.1	175.8	-73.2	-10.6	0	0	0	111.8	R747 T748 A754 S755	R747-N751 WeakPolarHBondContact O-CB 3.42Å; R747-N751 PolarHBondContact O-N 3.05Å; T748-N751 PolarHBondContact O-N 3.21Å; N751-A754 PolarHBondContact O-N 2.78Å; N751-S755 WeakPolarHBondContact O-CB 3.49Å; N751-S755 PolarHBondContact O-N 3.12Å
752	W	80.9	Confident	75.8	Confident	157 Å²	157	100.1 Å²	100.1	60%	0.595	51%	0.514	S	S	*	.	H	α-helix	trans	-62.6	-47.1	173.5	178.3	85.5	0	0	0	111.6	T748 M750 A754 S755 Q756	T748-W752 WeakPolarHBondContact O-CB 3.5Å; T748-W752 PolarHBondContact O-N 3.09Å; M750-W752 PolarHBondContact O-N 2.77Å; W752-A754 VanDerWaalsContact C-N 3.26Å; W752-A754 PolarHBondContact O-N 2.85Å; W752-S755 WeakPolarHBondContact O-CB 3.46Å; W752-S755 PolarHBondContact O-N 2.94Å; W752-S755 VanDerWaalsContact O-N 3.16Å; W752-Q756 HydrophobicContact CD2-CG 4.05Å; W752-Q756 HydrophobicContact CE3-CG 4.41Å; W752-Q756 HydrophobicContact CH2-CG 4.14Å; W752-Q756 HydrophobicContact CZ2-CG 3.77Å; W752-Q756 HydrophobicContact CZ3-CG 4.45Å; W752-Q756 WeakPolarHBondContact O-CG 3.47Å; W752-Q756 PolarHBondContact O-N 2.72Å
753	R	79.4	Confident	73.8	Confident	131 Å²	131	99 Å²	99	49%	0.494	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-30.9	175.2	-75	171.3	177.8	171.4	-0.6	113.3	I749 M750 K757	I749-R753 WeakPolarHBondContact O-CB 3.42Å; I749-R753 VanDerWaalsContact O-CG 3.23Å; I749-R753 WeakPolarHBondContact O-CG 3.32Å; I749-R753 PolarHBondContact O-N 3.14Å; M750-R753 PolarHBondContact O-N 3.07Å; R753-K757 WeakPolarHBondContact O-CD 3.48Å; R753-K757 WeakPolarHBondContact O-CG 3.4Å
754	A	73.3	Confident	71.4	Confident	48 Å²	48	99.8 Å²	99.8	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-74.9	-42.5	174	0	0	0	0	0	111.4	M750 N751 W752 K757 T758	M750-A754 WeakPolarHBondContact O-CB 3.37Å; M750-A754 PolarHBondContact O-N 3.11Å; N751-A754 PolarHBondContact O-N 2.78Å; W752-A754 VanDerWaalsContact C-N 3.26Å; W752-A754 PolarHBondContact O-N 2.85Å; A754-K757 PolarHBondContact O-N 3.17Å; A754-K757 VanDerWaalsContact O-N 3.11Å; A754-T758 WeakPolarHBondContact O-CG2 3.25Å; A754-T758 PolarHBondContact O-N 3.36Å; A754-T758 VanDerWaalsContact O-N 3.08Å; A754-T758 PolarHBondContact O-OG1 3.33Å
755	S	71.9	Confident	69.3	Low	22 Å²	22	99.1 Å²	99.1	15%	0.154	54%	0.536	C	S	.	.	H	α-helix	trans	-57.7	-49.4	175.2	-176	0	0	0	0	111.9	N751 W752 K757 T758 G759 I760 S761	N751-S755 WeakPolarHBondContact O-CB 3.49Å; N751-S755 PolarHBondContact O-N 3.12Å; W752-S755 WeakPolarHBondContact O-CB 3.46Å; W752-S755 PolarHBondContact O-N 2.94Å; W752-S755 VanDerWaalsContact O-N 3.16Å; S755-K757 PolarHBondContact O-N 3.29Å; S755-K757 VanDerWaalsContact O-N 3.11Å; S755-T758 PolarHBondContact O-N 3.41Å; S755-T758 PolarHBondContact O-OG1 2.97Å; S755-G759 PolarHBondContact O-N 3.43Å; S755-I760 WeakPolarHBondContact CA-O 3.12Å; S755-I760 WeakPolarHBondContact CB-O 3.42Å; S755-I760 PolarHBondContact OG-O 2.69Å; S755-S761 WeakPolarHBondContact OG-CA 3.34Å
756	Q	73.2	Confident	66.9	Low	129 Å²	129	97.2 Å²	97.2	60%	0.603	54%	0.541	S	S	*	.	H	α-helix	trans	-57.7	-26.2	175.6	-67.3	-64.2	-49.2	0	0	113.7	W752	W752-Q756 HydrophobicContact CD2-CG 4.05Å; W752-Q756 HydrophobicContact CE3-CG 4.41Å; W752-Q756 HydrophobicContact CH2-CG 4.14Å; W752-Q756 HydrophobicContact CZ2-CG 3.77Å; W752-Q756 HydrophobicContact CZ3-CG 4.45Å; W752-Q756 WeakPolarHBondContact O-CG 3.47Å; W752-Q756 PolarHBondContact O-N 2.72Å
757	K	72.3	Confident	64.4	Low	180 Å²	180	101.5 Å²	101.5	78%	0.783	56%	0.559	S	S	*	*	H	α-helix	trans	-92.1	-14.3	178.3	-70.8	174.9	-177.8	178.6	0	114.4	R753 A754 S755	R753-K757 WeakPolarHBondContact O-CD 3.48Å; R753-K757 WeakPolarHBondContact O-CG 3.4Å; A754-K757 PolarHBondContact O-N 3.17Å; A754-K757 VanDerWaalsContact O-N 3.11Å; S755-K757 PolarHBondContact O-N 3.29Å; S755-K757 VanDerWaalsContact O-N 3.11Å
758	T	72.6	Confident	61.8	Low	89 Å²	89	104.4 Å²	104.4	55%	0.546	58%	0.575	S	S	.	*	H	α-helix	trans	-115.9	-13.1	-174.5	53.2	0	0	0	0	113.4	A754 S755 I760	A754-T758 WeakPolarHBondContact O-CG2 3.25Å; A754-T758 PolarHBondContact O-N 3.36Å; A754-T758 VanDerWaalsContact O-N 3.08Å; A754-T758 PolarHBondContact O-OG1 3.33Å; S755-T758 PolarHBondContact O-N 3.41Å; S755-T758 PolarHBondContact O-OG1 2.97Å; T758-I760 PolarHBondContact O-N 3.47Å
759	G	58.7	Low	59.2	Low	74 Å²	74	110.5 Å²	110.5	76%	0.763	60%	0.596	S	S	*	*	S	Bend	trans	72	-2.4	-172.7	0	0	0	0	0	114	S755	S755-G759 PolarHBondContact O-N 3.43Å
760	I	59.2	Low	56.7	Low	122 Å²	122	111.9 Å²	111.9	63%	0.626	62%	0.616	S	S	*	*			trans	-96.1	109.8	-175.5	-62.1	172.2	0	0	0	108.7	S755 T758 G762	S755-I760 WeakPolarHBondContact CA-O 3.12Å; S755-I760 WeakPolarHBondContact CB-O 3.42Å; S755-I760 PolarHBondContact OG-O 2.69Å; T758-I760 PolarHBondContact O-N 3.47Å; I760-G762 VanDerWaalsContact C-N 3.29Å; I760-G762 PolarHBondContact O-N 2.85Å
761	S	48.2	Very low	54.6	Low	86 Å²	86	113.8 Å²	113.8	60%	0.601	63%	0.628	S	S	*	*			trans	-72.4	82.4	173.7	-174.1	0	0	0	0	110.7	R611 S755 S763	R611-S761 PolarHBondContact NH1-O 2.92Å; S755-S761 WeakPolarHBondContact OG-CA 3.34Å; S761-S763 PolarHBondContact O-N 2.95Å; S761-S763 VanDerWaalsContact O-N 3.08Å
762	G	45.6	Very low	52.5	Low	60 Å²	60	114.5 Å²	114.5	62%	0.619	64%	0.64	S	S	*	*			trans	-61	106.5	179.5	0	0	0	0	0	111.8	I760	I760-G762 VanDerWaalsContact C-N 3.29Å; I760-G762 PolarHBondContact O-N 2.85Å
763	S	43.2	Very low	50.9	Low	70 Å²	70	115.3 Å²	115.3	49%	0.49	66%	0.655	S	S	.	*			trans	-51.3	151.9	158.5	-163.3	0	0	0	0	109.7	S761 V765	S761-S763 PolarHBondContact O-N 2.95Å; S761-S763 VanDerWaalsContact O-N 3.08Å; S763-V765 PolarHBondContact O-N 3.33Å
764	P	42.7	Very low	49	Very low	112 Å²	112	118 Å²	118	73%	0.727	67%	0.673	S	S	*	*	S	Bend	trans	-45.6	136.2	172.6	17.3	-33	0	0	0	111.2	V766	P764-V766 PolarHBondContact O-N 3.2Å
765	V	39.3	Very low	48	Very low	117 Å²	117	124.3 Å²	124.3	71%	0.709	70%	0.695	S	S	*	*			trans	-63.5	102.2	-174.3	178.9	0	0	0	0	108.6	S763 K767	S763-V765 PolarHBondContact O-N 3.33Å; V765-K767 PolarHBondContact O-N 2.94Å
766	V	36.8	Very low	46.5	Very low	115 Å²	115	130 Å²	130	70%	0.697	72%	0.723	S	S	*	*			trans	-58.2	110.2	163.5	177.6	0	0	0	0	106.1	P764 K768	P764-V766 PolarHBondContact O-N 3.2Å; V766-K768 PolarHBondContact O-N 3.37Å
767	K	36.2	Very low	45.3	Very low	186 Å²	186	128.8 Å²	128.8	81%	0.809	72%	0.721	S	S	*	*			trans	-58.8	95.1	160.6	-77.8	-174.9	177.1	180	0	106.2	V765 F769	V765-K767 PolarHBondContact O-N 2.94Å; K767-F769 PolarHBondContact O-N 2.76Å
768	K	30.4	Very low	43.9	Very low	181 Å²	181	128.7 Å²	128.7	79%	0.787	72%	0.721	S	S	*	*			trans	-60.3	124.6	160.5	-70	-173.1	176.2	-173.9	0	105.7	V766 A770	V766-K768 PolarHBondContact O-N 3.37Å; K768-A770 PolarHBondContact O-N 3.44Å; K768-A770 VanDerWaalsContact O-N 3.09Å
769	F	30.4	Very low	42.7	Very low	192 Å²	192	127.6 Å²	127.6	84%	0.842	72%	0.721	S	S	*	*			trans	-58.6	114.9	158.2	-68.4	-88	0	0	0	105.8	K767 D771	K767-F769 PolarHBondContact O-N 2.76Å; F769-D771 PolarHBondContact O-N 3Å
770	A	34.1	Very low	41.7	Very low	84 Å²	84	130.7 Å²	130.7	69%	0.694	71%	0.713	S	S	*	*			trans	-94.7	84.8	-178.7	0	0	0	0	0	107	K768 S772	K768-A770 PolarHBondContact O-N 3.44Å; K768-A770 VanDerWaalsContact O-N 3.09Å; A770-S772 PolarHBondContact O-N 3.26Å
771	D	38.5	Very low	40.8	Very low	152 Å²	152	130.4 Å²	130.4	81%	0.813	72%	0.717	S	S	*	*			trans	-68.5	85.8	169	-59.1	-24.7	0	0	0	107.7	F769	F769-D771 PolarHBondContact O-N 3Å
772	S	35.3	Very low	40.3	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	72%	0.724	S	S	*	*			trans	-159.1	103.6	176.2	-68.2	0	0	0	0	109.6	A770 E774	A770-S772 PolarHBondContact O-N 3.26Å; S772-E774 PolarHBondContact O-N 3.05Å; S772-E774 VanDerWaalsContact O-N 3.12Å
773	D	47.3	Very low	40.2	Very low	173 Å²	173	138.4 Å²	138.4	93%	0.925	72%	0.724	S	S	*	*			trans	-72.3	94.9	173.7	-53.5	-79.1	0	0	0	110.9
774	E	40.3	Very low	40.2	Very low	187 Å²	187	141.6 Å²	141.6	87%	0.874	74%	0.735	S	S	*	*			trans	-128.8	134	157.9	-70.2	-165.6	158.3	0	0	109.3	S772	S772-E774 PolarHBondContact O-N 3.05Å; S772-E774 VanDerWaalsContact O-N 3.12Å
775	E	51.8	Low	40	Very low	182 Å²	182	145 Å²	145	85%	0.85	74%	0.738	S	S	*	*			trans	-85.7	127.1	-166.8	-62.3	-171.2	142.9	0	0	113.6
776	D	39.9	Very low	40.1	Very low	140 Å²	140	147 Å²	147	75%	0.749	75%	0.745	S	S	*	*			trans	-122.3	66.1	171.5	-133.7	-23.5	0	0	0	110.7	K778	D776-K778 PolarHBondContact O-N 2.97Å
777	D	49.7	Very low	40.1	Very low	104 Å²	104	145 Å²	145	56%	0.556	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	47.5	-161.9	-138.7	36.9	0	0	0	114.4	K780	D777-K780 WeakPolarHBondContact OD1-CE 3.33Å; D777-K780 IonicContact OD1-NZ 3.61Å; D777-K780 PolarHBondContact OD1-NZ 2.83Å
778	K	42.6	Very low	40.1	Very low	179 Å²	179	143.8 Å²	143.8	78%	0.778	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	-7.8	-178.4	-74.9	170.8	-176.2	154.4	0	115	D776	D776-K778 PolarHBondContact O-N 2.97Å
779	A	46.1	Very low	40.2	Very low	66 Å²	66	141 Å²	141	55%	0.545	74%	0.742	S	S	.	*	S	Bend	trans	-94.7	-17.6	-178	0	0	0	0	0	114.8	T781 W782	A779-T781 PolarHBondContact O-N 2.82Å; A779-W782 PolarHBondContact O-NE1 2.65Å
780	K	39.4	Very low	40.3	Very low	139 Å²	139	139.7 Å²	139.7	60%	0.604	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-15.9	-168.5	-62.3	171	-171.7	157.6	0	114.7	D777 W782	D777-K780 WeakPolarHBondContact OD1-CE 3.33Å; D777-K780 IonicContact OD1-NZ 3.61Å; D777-K780 PolarHBondContact OD1-NZ 2.83Å; K780-W782 VanDerWaalsContact C-N 3.35Å; K780-W782 PolarHBondContact O-N 3.26Å
781	T	39.8	Very low	40.3	Very low	115 Å²	115	145.5 Å²	145.5	71%	0.706	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-6.3	-165.4	3.3	0	0	0	0	116.3	A779	A779-T781 PolarHBondContact O-N 2.82Å
782	W	36.5	Very low	40	Very low	194 Å²	194	146.3 Å²	146.3	74%	0.735	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-25.8	-178.2	71.2	-83.4	0	0	0	114.6	A779 K780	A779-W782 PolarHBondContact O-NE1 2.65Å; K780-W782 VanDerWaalsContact C-N 3.35Å; K780-W782 PolarHBondContact O-N 3.26Å
783	L	43.2	Very low	40	Very low	120 Å²	120	150.6 Å²	150.6	63%	0.628	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-13.4	-177.3	-78.9	164.5	0	0	0	114.6
784	L	43.7	Very low	39.6	Very low	138 Å²	138	151.7 Å²	151.7	72%	0.723	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	11	-169.9	-95.5	155.2	0	0	0	115.5
785	K	39.7	Very low	39.1	Very low	182 Å²	182	147.7 Å²	147.7	79%	0.791	76%	0.757	S	S	*	*	S	Bend	trans	-97.5	-14.3	-178.8	-76.4	-169.3	174.1	-175.5	0	116.1
786	N	39.9	Very low	38.3	Very low	159 Å²	159	145.4 Å²	145.4	85%	0.85	76%	0.757	S	S	*	*	S	Bend	trans	-115.3	14.8	-172.9	-66.8	18	0	0	0	113.5
787	A	37.7	Very low	38	Very low	75 Å²	75	144.5 Å²	144.5	62%	0.62	76%	0.757	S	S	*	*			trans	-101.7	128.5	179.8	0	0	0	0	0	111.7
788	I	35.8	Very low	37.4	Very low	160 Å²	160	148.5 Å²	148.5	82%	0.821	77%	0.77	S	S	*	*			trans	-74.5	136.3	174.1	-62.9	174.4	0	0	0	108.7	I790	I788-I790 PolarHBondContact O-N 2.89Å
789	P	32.4	Very low	36.6	Very low	122 Å²	122	151.1 Å²	151.1	79%	0.792	78%	0.776	S	S	*	*			trans	-77.8	112.9	-165.1	29.1	-35.8	0	0	0	113.7
790	I	33.2	Very low	36.2	Very low	164 Å²	164	153.4 Å²	153.4	84%	0.841	79%	0.786	S	S	*	*			trans	-87.7	128.8	159.8	-59.4	177.2	0	0	0	107.7	I788	I788-I790 PolarHBondContact O-N 2.89Å
791	K	33.9	Very low	35.8	Very low	206 Å²	206	153.5 Å²	153.5	90%	0.896	80%	0.797	S	S	*	*			trans	-72.7	128.5	175.8	-65.6	-180	-178.5	177.6	0	109.6
792	L	31.3	Very low	35.5	Very low	170 Å²	170	153.8 Å²	153.8	89%	0.89	80%	0.799	S	S	*	*			trans	-104.4	130.5	174	-166.3	70.4	0	0	0	108.7
793	E	35.1	Very low	35.6	Very low	188 Å²	188	149.8 Å²	149.8	88%	0.879	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.4	155.5	174.1	-75.4	-175.7	115.8	0	0	111.8
794	E	38.9	Very low	35	Very low	196 Å²	196	150.3 Å²	150.3	92%	0.916	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.3	135.1	-178.3	-64.8	-175.9	115.8	0	0	112.1
795	S	31.5	Very low	34.2	Very low	103 Å²	103	154 Å²	154	72%	0.72	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.5	137.1	176.6	55.5	0	0	0	0	112
796	P	34	Very low	33.9	Very low	133 Å²	133	151.5 Å²	151.5	86%	0.864	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67	152.8	179.3	28.5	-35.3	0	0	0	112.5
797	T	33.8	Very low	33.5	Very low	122 Å²	122	155.7 Å²	155.7	75%	0.748	82%	0.816	S	S	*	*			trans	-105.4	143.9	-165.1	58.1	0	0	0	0	114.6
798	K	36.2	Very low	33.1	Very low	188 Å²	188	164 Å²	164	82%	0.817	83%	0.831	S	S	*	*			trans	54	132.6	155.6	-65.8	173.6	179.3	174	0	119.5
799	Y	25.6	Very low	32.9	Very low	233 Å²	233	161.3 Å²	161.3	91%	0.914	83%	0.826	S	S	*	*			trans	-154.9	170.3	133.3	-97.7	-51.3	0	0	0	110.1
800	P	37.8	Very low	32.9	Very low	115 Å²	115	167 Å²	167	75%	0.747	83%	0.832	S	S	*	*	P	Polyproline II helix		-103.5	165.7	-121	39.6	-37.2	0	0	0	117.1
801	V	32.2	Very low	32.9	Very low	140 Å²	140	165.3 Å²	165.3	85%	0.848	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-84.5	139.9	178.2	176.6	0	0	0	0	112
802	T	32.3	Very low	32.9	Very low	122 Å²	122	160.9 Å²	160.9	75%	0.748	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-102.9	146.4	164.8	52.1	0	0	0	0	111.5
803	P	39.2	Very low	32.9	Very low	109 Å²	109	160.4 Å²	160.4	71%	0.708	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-78	146.5	-158.7	29.7	-36.8	0	0	0	115.9
804	V	29.9	Very low	32.7	Very low	132 Å²	132	156.1 Å²	156.1	80%	0.8	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-86.2	122.2	173.5	177.2	0	0	0	0	110.5	T806	V804-T806 PolarHBondContact O-N 2.9Å
805	Y	28.3	Very low	32.5	Very low	216 Å²	216	153.5 Å²	153.5	85%	0.847	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-78.5	117.9	169.8	-80.9	-83.9	0	0	0	111.3
806	T	33.2	Very low	32.5	Very low	128 Å²	128	154.7 Å²	154.7	79%	0.785	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.2	134.3	178.2	50.4	0	0	0	0	111.7	V804 R808	V804-T806 PolarHBondContact O-N 2.9Å; T806-R808 PolarHBondContact O-N 3.29Å
807	R	30.7	Very low	32.4	Very low	247 Å²	247	158.5 Å²	158.5	93%	0.932	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76.8	119.5	173.8	-76.7	-172.9	172.2	-132.2	-0.4	110.6
808	R	29.8	Very low	32.4	Very low	250 Å²	250	160.9 Å²	160.9	94%	0.943	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-65.7	157.9	160.8	-85.9	-170.7	172.1	-153.3	-1.5	110.9	T806	T806-R808 PolarHBondContact O-N 3.29Å
809	S	31.4	Very low	32.2	Very low	103 Å²	103	156.4 Å²	156.4	72%	0.72	80%	0.8	S	S	*	*			trans	-133.9	145.8	-173.8	62.2	0	0	0	0	112.8
810	R	32.4	Very low	32.2	Very low	242 Å²	242	151.5 Å²	151.5	91%	0.913	79%	0.794	S	S	*	*			trans	63.5	123.8	166.3	-50.6	176.4	74.4	158.9	3.2	118.3
811	S	34	Very low	32	Very low	128 Å²	128	151.6 Å²	151.6	90%	0.895	80%	0.797	S	S	*	*				-162.6	-161.6	116.3	60.7	0	0	0	0	109.8
812	S	32.8	Very low	32	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	80%	0.796	S	S	*	*			trans	-107	174	-149.3	54.6	0	0	0	0	116.7
813	L	32.8	Very low	31.8	Very low	159 Å²	159	153.2 Å²	153.2	83%	0.832	80%	0.796	S	S	*	*			trans	-58.2	166.8	168.1	-68.9	163.2	0	0	0	114
814	S	30.6	Very low	31.5	Very low	98 Å²	98	154.8 Å²	154.8	69%	0.685	80%	0.803	S	S	*	*			trans	115.9	123.8	143.6	-64.2	0	0	0	0	117.1
815	D	33.4	Very low	31.6	Very low	141 Å²	141	152 Å²	152	75%	0.754	80%	0.802	S	S	*	*			trans	66.2	151.9	144.3	-56.5	-26.6	0	0	0	119.1
816	I	32.8	Very low	31.5	Very low	128 Å²	128	146.9 Å²	146.9	66%	0.656	80%	0.797	S	S	*	*			cis	-156.1	125.3	-13.5	-112.8	165.9	0	0	0	104.8
817	R	31.2	Very low	31.4	Very low	213 Å²	213	147.3 Å²	147.3	80%	0.804	79%	0.793	S	S	*	*				82.5	160.3	89.8	-140.6	-176.2	-163.1	147.9	2.4	114.3
818	E	33.6	Very low	31.4	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	78%	0.784	S	S	*	*			trans	67.2	155.6	176.7	-75	164	-154.6	0	0	116
819	S	31.8	Very low	32.2	Very low	94 Å²	94	134.7 Å²	134.7	66%	0.657	77%	0.774	S	S	*	*			cis	177.1	160.8	-30.4	58.1	0	0	0	0	106.3
820	T	26.3	Very low	32.6	Very low	131 Å²	131	135.3 Å²	135.3	80%	0.804	78%	0.778	S	S	*	*			cis	-165.8	132.4	-19.8	22.6	0	0	0	0	106.4
821	S	33.7	Very low	33.1	Very low	116 Å²	116	128.3 Å²	128.3	81%	0.811	76%	0.762	S	S	*	*			trans	-165	138.6	159.5	55.5	0	0	0	0	112.2
822	E	31	Very low	34.1	Very low	176 Å²	176	125 Å²	125	82%	0.822	74%	0.739	S	S	*	*			trans	-31	153.5	168.6	-65.7	130.3	-133	0	0	116.8
823	T	29.4	Very low	34.6	Very low	120 Å²	120	126 Å²	126	74%	0.736	74%	0.735	S	S	*	*			cis	-160.1	157.4	33.4	-20	0	0	0	0	113.2
824	T	32.1	Very low	35.4	Very low	142 Å²	142	122.5 Å²	122.5	87%	0.871	72%	0.724	S	S	*	*			trans	60.8	127.6	161.3	58.2	0	0	0	0	121.3
825	G	31.6	Very low	36.3	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	72%	0.715	S	S	*	*			trans	112.6	82.6	159.8	0	0	0	0	0	116.3
826	S	26.4	Very low	37.5	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	71%	0.711	S	S	*	*			trans	-170.1	152.8	-172.6	-91.3	0	0	0	0	111.3
827	I	31.4	Very low	38.5	Very low	137 Å²	137	123.1 Å²	123.1	70%	0.703	70%	0.703	S	S	*	*			cis	-161.6	144.2	1.8	-127.1	167.2	0	0	0	112.2
828	T	31	Very low	39.4	Very low	121 Å²	121	120.9 Å²	120.9	74%	0.742	70%	0.699	S	S	*	*			trans	64	174.7	156.2	65.2	0	0	0	0	118.7
829	P	46.1	Very low	40.2	Very low	111 Å²	111	116 Å²	116	72%	0.721	69%	0.688	S	S	*	*			cis	-133.1	167.4	4.5	42.7	-26	0	0	0	119.2
830	S	39.3	Very low	40.9	Very low	117 Å²	117	118.6 Å²	118.6	82%	0.818	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-82.8	135.8	159.7	54.4	0	0	0	0	111.3
831	T	43	Very low	42	Very low	94 Å²	94	119.6 Å²	119.6	58%	0.577	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-90.6	156.6	174.2	50.7	0	0	0	0	113.1	E835	T831-E835 WeakPolarHBondContact CG2-OE1 3.39Å
832	S	55.7	Low	42.4	Very low	59 Å²	59	122.1 Å²	122.1	41%	0.413	69%	0.686	S	S	.	*	P	Polyproline II helix	trans	-91.7	167.5	-171.4	72	0	0	0	0	113.7	S834 E835	S832-S834 VanDerWaalsContact C-N 3.27Å; S832-S834 PolarHBondContact O-N 3.12Å; S832-E835 WeakPolarHBondContact CB-OE2 3.38Å; S832-E835 PolarHBondContact N-OE2 2.93Å; S832-E835 PolarHBondContact O-N 2.81Å; S832-E835 PolarHBondContact OG-OE2 3.35Å
833	L	44.2	Very low	42.9	Very low	134 Å²	134	121 Å²	121	70%	0.702	69%	0.685	S	S	*	*	H	α-helix	trans	-65	-30.5	179.5	-144.9	161.3	0	0	0	112	E835 R836 I837	L833-E835 PolarHBondContact O-N 3.08Å; L833-R836 PolarHBondContact O-N 3.31Å; L833-I837 HydrophobicContact CD2-CD1 3.81Å; L833-I837 HydrophobicContact CD2-CG1 4.33Å
834	S	49.2	Very low	43.4	Very low	87 Å²	87	121.7 Å²	121.7	61%	0.608	68%	0.684	S	S	*	*	H	α-helix	trans	-67.6	-31.3	178	-63.9	0	0	0	0	114	S832 R836 I837 K838	S832-S834 VanDerWaalsContact C-N 3.27Å; S832-S834 PolarHBondContact O-N 3.12Å; S834-R836 VanDerWaalsContact C-N 3.34Å; S834-I837 PolarHBondContact O-N 3.02Å; S834-K838 PolarHBondContact O-N 3.47Å
835	E	50.1	Low	43.5	Very low	105 Å²	105	122 Å²	122	49%	0.491	68%	0.68	S	S	.	*	H	α-helix	trans	-70	-33.4	178.9	-73	158	98	0	0	111.7	T831 S832 L833 I837 A839	T831-E835 WeakPolarHBondContact CG2-OE1 3.39Å; S832-E835 WeakPolarHBondContact CB-OE2 3.38Å; S832-E835 PolarHBondContact N-OE2 2.93Å; S832-E835 PolarHBondContact O-N 2.81Å; S832-E835 PolarHBondContact OG-OE2 3.35Å; L833-E835 PolarHBondContact O-N 3.08Å; E835-I837 VanDerWaalsContact C-N 3.32Å; E835-I837 PolarHBondContact O-N 3.23Å; E835-A839 PolarHBondContact O-N 2.92Å
836	R	57.3	Low	43.4	Very low	180 Å²	180	126.9 Å²	126.9	68%	0.679	68%	0.683	S	S	*	*	H	α-helix	trans	-72.3	-25.8	177.6	-144.8	176.8	-60	172.7	3	113.1	L833 S834	L833-R836 PolarHBondContact O-N 3.31Å; S834-R836 VanDerWaalsContact C-N 3.34Å
837	I	54.7	Low	43.6	Very low	94 Å²	94	128 Å²	128	48%	0.482	69%	0.685	S	S	.	*	H	α-helix	trans	-77.1	-41	177.8	-66.7	170.5	0	0	0	110.9	L833 S834 E835 A839 M840	L833-I837 HydrophobicContact CD2-CD1 3.81Å; L833-I837 HydrophobicContact CD2-CG1 4.33Å; S834-I837 PolarHBondContact O-N 3.02Å; E835-I837 VanDerWaalsContact C-N 3.32Å; E835-I837 PolarHBondContact O-N 3.23Å; I837-A839 VanDerWaalsContact C-N 3.3Å; I837-A839 PolarHBondContact O-N 3.02Å; I837-M840 PolarHBondContact O-N 2.71Å
838	K	50.1	Low	43.4	Very low	167 Å²	167	126.8 Å²	126.8	73%	0.726	69%	0.688	S	S	*	*	H	α-helix	trans	-66.1	-29.4	174.7	-81.7	-165.5	170.2	-169	0	113.7	S834 M840 Q841	S834-K838 PolarHBondContact O-N 3.47Å; K838-M840 PolarHBondContact O-N 3.47Å; K838-Q841 PolarHBondContact O-N 3.41Å
839	A	49.3	Very low	43.3	Very low	69 Å²	69	125.9 Å²	125.9	57%	0.57	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-15.7	179.1	0	0	0	0	0	114.6	E835 I837	E835-A839 PolarHBondContact O-N 2.92Å; I837-A839 VanDerWaalsContact C-N 3.3Å; I837-A839 PolarHBondContact O-N 3.02Å
840	M	47.4	Very low	42.4	Very low	148 Å²	148	130.2 Å²	130.2	73%	0.729	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-18.9	178.9	-74.1	178.3	58.5	0	0	114.2	I837 K838 H842	I837-M840 PolarHBondContact O-N 2.71Å; K838-M840 PolarHBondContact O-N 3.47Å; M840-H842 PolarHBondContact O-N 2.71Å
841	Q	49.9	Very low	41.8	Very low	153 Å²	153	131.6 Å²	131.6	72%	0.715	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	21.8	-172.6	-60.5	-171	-71.6	0	0	113.7	K838	K838-Q841 PolarHBondContact O-N 3.41Å
842	H	41.2	Very low	41.1	Very low	168 Å²	168	134.4 Å²	134.4	78%	0.778	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	14.7	-172.1	-142.7	-54.7	0	0	0	114.4	M840	M840-H842 PolarHBondContact O-N 2.71Å
843	L	41.5	Very low	39.9	Very low	153 Å²	153	139.2 Å²	139.2	80%	0.801	71%	0.708	S	S	*	*	S	Bend	trans	-102.6	-20.7	168.3	-73.7	169.7	0	0	0	112.3	N845	L843-N845 PolarHBondContact O-N 2.93Å
844	D	40.5	Very low	39.2	Very low	134 Å²	134	138.7 Å²	138.7	72%	0.717	70%	0.701	S	S	*	*	S	Bend	trans	-91.2	79.8	173.5	-59.8	-42.1	0	0	0	110
845	N	34	Very low	38.1	Very low	149 Å²	149	142.7 Å²	142.7	80%	0.797	72%	0.715	S	S	*	*			trans	170.6	139.9	142.2	-87.1	-25.3	0	0	0	113.1	L843	L843-N845 PolarHBondContact O-N 2.93Å
846	E	29.8	Very low	37.3	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	72%	0.723	S	S	*	*			trans	69.9	114.3	166.9	-65.8	173.2	-156.5	0	0	117.2
847	V	30.3	Very low	36.1	Very low	132 Å²	132	143 Å²	143	80%	0.8	73%	0.729	S	S	*	*				89.4	138.1	52.9	170.2	0	0	0	0	110.3
848	C	27.4	Very low	35	Very low	111 Å²	111	146.1 Å²	146.1	75%	0.75	75%	0.747	S	S	*	*			cis	-149.1	176	28.9	-144.6	0	0	0	0	116
849	V	28.1	Very low	34	Very low	102 Å²	102	142.2 Å²	142.2	62%	0.618	75%	0.746	S	S	*	*			trans	-11.3	143.8	150.6	169.9	0	0	0	0	119.7	Q851	V849-Q851 HydrophobicContact CG1-CB 4.39Å
850	E	27.4	Very low	33.1	Very low	201 Å²	201	148.5 Å²	148.5	94%	0.939	76%	0.756	S	S	*	*				-132.3	170.8	126.5	-76.7	-152.4	151.6	0	0	109.9
851	Q	27.2	Very low	32.3	Very low	146 Å²	146	149.9 Å²	149.9	68%	0.682	76%	0.758	S	S	*	*			trans	-142.2	176.7	-151	-155.3	179	-90	0	0	112	V849	V849-Q851 HydrophobicContact CG1-CB 4.39Å
852	E	28.1	Very low	31.9	Very low	153 Å²	153	150.9 Å²	150.9	72%	0.715	77%	0.765	S	S	*	*			trans	72.8	147.4	163.5	-66.9	162.3	-158.5	0	0	115.8
853	E	30.3	Very low	31.5	Very low	160 Å²	160	149.3 Å²	149.3	75%	0.748	76%	0.762	S	S	*	*			cis	-144.5	135.9	-9.8	-117.1	-172.5	159.3	0	0	106.9
854	K	28.6	Very low	31	Very low	124 Å²	124	148.4 Å²	148.4	54%	0.539	76%	0.759	S	S	.	*				76.2	124.1	90.9	-175.2	-176.3	-179.6	179.3	0	115.1	E856	K854-E856 WeakPolarHBondContact CE-OE1 3.24Å; K854-E856 WeakPolarHBondContact CE-OE2 3.19Å; K854-E856 IonicContact NZ-OE1 3.07Å; K854-E856 PolarHBondContact NZ-OE1 2.75Å; K854-E856 IonicContact NZ-OE2 3.28Å; K854-E856 PolarHBondContact NZ-OE2 2.6Å
855	D	27.1	Very low	30.5	Very low	170 Å²	170	150.4 Å²	150.4	91%	0.909	76%	0.761	S	S	*	*			trans	-147.4	150.3	143.6	-96.6	-36.2	0	0	0	107.5
856	E	33.6	Very low	30.2	Very low	140 Å²	140	150.2 Å²	150.2	65%	0.654	76%	0.755	S	S	*	*			trans	-114.9	162.1	-176.5	-71	163.7	155.5	0	0	109.9	K854	K854-E856 WeakPolarHBondContact CE-OE1 3.24Å; K854-E856 WeakPolarHBondContact CE-OE2 3.19Å; K854-E856 IonicContact NZ-OE1 3.07Å; K854-E856 PolarHBondContact NZ-OE1 2.75Å; K854-E856 IonicContact NZ-OE2 3.28Å; K854-E856 PolarHBondContact NZ-OE2 2.6Å
857	D	32.3	Very low	30.4	Very low	152 Å²	152	148 Å²	148	81%	0.813	75%	0.749	S	S	*	*			trans	179.6	133	133.7	-92.7	-14.5	0	0	0	114
858	D	30	Very low	30.4	Very low	159 Å²	159	147 Å²	147	85%	0.85	74%	0.744	S	S	*	*			trans	62.5	159.6	151.5	-73.2	-14.5	0	0	0	124
859	A	30.2	Very low	30.6	Very low	86 Å²	86	148.9 Å²	148.9	71%	0.711	74%	0.744	S	S	*	*			trans	-156.9	-175.1	-160.6	0	0	0	0	0	112.4
860	Y	29.6	Very low	30.8	Very low	200 Å²	200	152.2 Å²	152.2	78%	0.784	76%	0.757	S	S	*	*			trans	62.6	106.4	159.4	-102.8	-80.1	0	0	0	118.3
861	F	30.8	Very low	31	Very low	177 Å²	177	151.3 Å²	151.3	78%	0.776	75%	0.753	S	S	*	*				-173.9	158.7	90.5	-116.4	-84.6	0	0	0	112.2
862	M	42.2	Very low	31.1	Very low	174 Å²	174	149 Å²	149	86%	0.857	76%	0.759	S	S	*	*			trans	-111.1	138.1	164.8	-81.2	-81.6	-167.3	0	0	108.3
863	D	32.1	Very low	31.2	Very low	135 Å²	135	148.6 Å²	148.6	72%	0.722	76%	0.762	S	S	*	*			trans	-155.7	125.2	153.8	-117.8	-29.1	0	0	0	112.2
864	N	31.1	Very low	31.2	Very low	135 Å²	135	147.8 Å²	147.8	72%	0.722	76%	0.762	S	S	*	*			trans	16.9	147.9	136	-58	-53.9	0	0	0	119.3
865	K	30.2	Very low	31.4	Very low	176 Å²	176	148.8 Å²	148.8	77%	0.765	78%	0.778	S	S	*	*			cis	-167.6	164.6	37.9	-157	178	177	-172.9	0	113.2
866	E	28.5	Very low	31.6	Very low	144 Å²	144	148.6 Å²	148.6	67%	0.673	78%	0.777	S	S	*	*			trans	-72	161.7	166.4	-48	95.6	139.1	0	0	113.6
867	D	33.7	Very low	31.4	Very low	130 Å²	130	150.6 Å²	150.6	70%	0.695	79%	0.786	S	S	*	*				175.4	150.2	97.9	-105.8	-41.4	0	0	0	116.6
868	T	31.1	Very low	31.4	Very low	113 Å²	113	152.5 Å²	152.5	69%	0.693	79%	0.79	S	S	*	*			trans	48.6	117	157.1	55.8	0	0	0	0	120.8
869	I	31.3	Very low	31.3	Very low	149 Å²	149	151 Å²	151	76%	0.764	79%	0.786	S	S	*	*				72.9	121.5	62	-62.2	167.3	0	0	0	114.9
870	I	30.6	Very low	31.2	Very low	172 Å²	172	157.6 Å²	157.6	88%	0.882	79%	0.794	S	S	*	*			trans	-161.3	153	134.9	-99.8	157.5	0	0	0	108.6
871	E	32.5	Very low	31.1	Very low	182 Å²	182	153.3 Å²	153.3	85%	0.85	79%	0.788	S	S	*	*			trans	-101.5	160.5	-165.7	-54.5	155.2	129.8	0	0	113.5
872	A	30.3	Very low	31	Very low	99 Å²	99	153.4 Å²	153.4	82%	0.818	79%	0.792	S	S	*	*			trans	175.1	99.2	139.6	0	0	0	0	0	114.6
873	D	29	Very low	30.7	Very low	144 Å²	144	153.9 Å²	153.9	77%	0.77	79%	0.792	S	S	*	*				40.7	138.4	123.4	-92.7	12.9	0	0	0	126.1
874	L	31.6	Very low	30.6	Very low	143 Å²	143	155.1 Å²	155.1	75%	0.749	80%	0.798	S	S	*	*			trans	68.3	115.3	140.8	-62.7	166.6	0	0	0	121.5
875	T	31.4	Very low	30.5	Very low	145 Å²	145	156.5 Å²	156.5	89%	0.89	80%	0.802	S	S	*	*				178.8	161.7	96.6	29.6	0	0	0	0	113.6
876	L	31.6	Very low	30.5	Very low	166 Å²	166	154.2 Å²	154.2	87%	0.869	80%	0.803	S	S	*	*			trans	-97.1	151	174	-69.2	149.4	0	0	0	111
877	Q	29.6	Very low	30.5	Very low	181 Å²	181	151.5 Å²	151.5	85%	0.846	81%	0.805	S	S	*	*				-167.2	131.6	124.5	-116.2	172.1	-26.5	0	0	114.9
878	E	32.2	Very low	30.2	Very low	192 Å²	192	151 Å²	151	90%	0.897	81%	0.806	S	S	*	*			trans	-96.5	146.9	154.9	-60.8	177.7	131	0	0	108.5
879	V	27.8	Very low	30	Very low	127 Å²	127	151.4 Å²	151.4	77%	0.77	81%	0.809	S	S	*	*			trans	-140.2	145.8	168.7	-176.5	0	0	0	0	109.6
880	Y	27.6	Very low	29.9	Very low	225 Å²	225	150.3 Å²	150.3	88%	0.882	81%	0.809	S	S	*	*			trans	-110.1	-150.4	-169	-136.8	-102.5	0	0	0	110.9
881	V	28.4	Very low	29.7	Very low	110 Å²	110	151.3 Å²	151.3	67%	0.667	81%	0.81	S	S	*	*			trans	83.6	129.5	159	-178.8	0	0	0	0	115.4
882	E	28.6	Very low	29.6	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	81%	0.806	S	S	*	*			cis	-156.6	178.8	-12.3	-121.6	165.1	-177.5	0	0	111.2
883	Q	36.7	Very low	29.4	Very low	184 Å²	184	148.8 Å²	148.8	86%	0.86	81%	0.806	S	S	*	*			trans	-105.3	163.2	166.1	-62.1	-178.8	-89.2	0	0	110.5
884	D	28.2	Very low	29.4	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	80%	0.803	S	S	*	*			trans	-146.1	166.4	161.5	-139	-25.1	0	0	0	113
885	M	29.5	Very low	29.3	Very low	164 Å²	164	148.4 Å²	148.4	81%	0.808	81%	0.807	S	S	*	*			trans	-137.9	-171.2	-162.1	-76.9	-171.3	64.3	0	0	114.9
886	V	30.1	Very low	29.2	Very low	127 Å²	127	147.6 Å²	147.6	77%	0.77	80%	0.802	S	S	*	*			trans	83	119.2	165.4	-164.2	0	0	0	0	113.4
887	A	28.2	Very low	29.1	Very low	88 Å²	88	145.2 Å²	145.2	73%	0.727	80%	0.795	S	S	*	*			cis	78.3	155	48.1	0	0	0	0	0	113.2
888	V	28.9	Very low	29.1	Very low	118 Å²	118	143.2 Å²	143.2	72%	0.715	79%	0.79	S	S	*	*			cis	-164.2	162	9	80	0	0	0	0	111.9
889	T	25.8	Very low	29.1	Very low	123 Å²	123	141.5 Å²	141.5	76%	0.755	79%	0.785	S	S	*	*			trans	61.7	166.6	162.2	52.1	0	0	0	0	121.5
890	V	28.7	Very low	29.2	Very low	126 Å²	126	143.1 Å²	143.1	76%	0.764	79%	0.79	S	S	*	*			cis	-174.4	147.7	-39.2	141.9	0	0	0	0	106.9
891	E	26.3	Very low	29.5	Very low	193 Å²	193	136.7 Å²	136.7	90%	0.902	78%	0.783	S	S	*	*			trans	172.1	177.4	136.8	-94.3	-171.9	-171.1	0	0	112.5
892	S	30.3	Very low	29.7	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	79%	0.79	S	S	*	*			trans	-145.5	154.2	-150.3	58	0	0	0	0	116.7
893	S	27.8	Very low	30.1	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	79%	0.79	S	S	*	*			trans	-159.5	132.8	163.1	-67.5	0	0	0	0	115.7
894	S	28.8	Very low	29.9	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	78%	0.782	S	S	*	*			trans	25.3	122.6	147	60	0	0	0	0	124.8
895	E	29	Very low	30.1	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	78%	0.776	S	S	*	*				26.6	128.3	125.2	-52.3	176.1	125.8	0	0	122
896	T	28.9	Very low	30.2	Very low	128 Å²	128	136.1 Å²	136.1	79%	0.785	78%	0.776	S	S	*	*				163.5	151.8	109.6	37.1	0	0	0	0	114.9
897	T	30.6	Very low	30.4	Very low	115 Å²	115	134.4 Å²	134.4	71%	0.706	77%	0.774	S	S	*	*			trans	51.7	119.9	158.2	52.1	0	0	0	0	122.9
898	D	29.1	Very low	30.7	Very low	140 Å²	140	136.9 Å²	136.9	75%	0.749	78%	0.781	S	S	*	*				33.3	132.6	124	-41	-32.9	0	0	0	122.2
899	I	31.6	Very low	30.8	Very low	155 Å²	155	135.8 Å²	135.8	80%	0.795	78%	0.784	S	S	*	*				162.2	123.7	120.3	-82.8	158.6	0	0	0	112.1
900	D	30.1	Very low	31.1	Very low	162 Å²	162	138.9 Å²	138.9	87%	0.866	79%	0.793	S	S	*	*			trans	33.1	-169.6	150.5	-59.6	-38.1	0	0	0	122.5
901	A	34.5	Very low	31.3	Very low	89 Å²	89	137.9 Å²	137.9	74%	0.736	79%	0.791	S	S	*	*			trans	-133.6	177.4	-151.9	0	0	0	0	0	115.1
902	N	32	Very low	31.9	Very low	155 Å²	155	134.2 Å²	134.2	83%	0.829	78%	0.784	S	S	*	*			trans	86	145.9	164.3	-77.1	-6	0	0	0	120.6
903	E	36.6	Very low	32	Very low	177 Å²	177	135.6 Å²	135.6	83%	0.827	79%	0.787	S	S	*	*			trans	67.4	140.6	168	-64.1	-163.9	134.7	0	0	117.1
904	M	33.7	Very low	32	Very low	140 Å²	140	139.2 Å²	139.2	69%	0.69	79%	0.788	S	S	*	*			cis	-159.1	-167	0.4	-131.7	-174	74.6	0	0	111
905	I	32.5	Very low	32.3	Very low	146 Å²	146	140.9 Å²	140.9	75%	0.749	79%	0.794	S	S	*	*			trans	80.1	141.7	164.5	-48.1	-178.6	0	0	0	116
906	E	31.7	Very low	32.5	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	79%	0.792	S	S	*	*			cis	-164.8	173.2	-37.9	-162.6	156.3	-150.1	0	0	107.5
907	A	33	Very low	32.4	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	80%	0.796	S	S	*	*			trans	-78.4	151.9	-171.7	0	0	0	0	0	115.3
908	T	34.3	Very low	32.5	Very low	141 Å²	141	141.2 Å²	141.2	87%	0.865	80%	0.801	S	S	*	*			trans	-142.7	129.8	155	-71.9	0	0	0	0	109
909	A	31.8	Very low	32.9	Very low	95 Å²	95	144.4 Å²	144.4	79%	0.785	83%	0.825	S	S	*	*			trans	-87.7	151.8	-171.1	0	0	0	0	0	113.2
910	M	32.5	Very low	33	Very low	188 Å²	188	143.9 Å²	143.9	93%	0.926	83%	0.827	S	S	*	*			trans	-115.8	148.1	166.4	-67.6	-161.3	76.1	0	0	111.7
911	S	32.4	Very low	33.1	Very low	105 Å²	105	142.9 Å²	142.9	73%	0.734	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-70.3	144.4	-168.2	-178.6	0	0	0	0	113.9
912	P	38.3	Very low	33	Very low	115 Å²	115	145.9 Å²	145.9	75%	0.747	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-67.9	132.4	173.3	28.4	-35.1	0	0	0	112
913	V	32.3	Very low	33.1	Very low	139 Å²	139	145.4 Å²	145.4	84%	0.842	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-79.6	132.6	172	178.6	0	0	0	0	109.6	T915	V913-T915 PolarHBondContact O-N 2.86Å
914	K	29.1	Very low	32.9	Very low	193 Å²	193	143.4 Å²	143.4	84%	0.839	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-72.6	121.8	-177.8	-66.5	178.2	-178.9	175.3	0	111.4	T916	K914-T916 PolarHBondContact O-N 3.27Å
915	T	33.7	Very low	32.8	Very low	137 Å²	137	143.6 Å²	143.6	84%	0.84	84%	0.839	S	S	*	*			trans	-80.6	111.1	169.3	41.5	0	0	0	0	110.7	V913 L917	V913-T915 PolarHBondContact O-N 2.86Å; T915-L917 PolarHBondContact O-N 3.21Å
916	T	33.1	Very low	32.9	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	85%	0.846	S	S	*	*			trans	-82.2	100.6	173.5	49.2	0	0	0	0	110.7	K914	K914-T916 PolarHBondContact O-N 3.27Å
917	L	28.4	Very low	32.9	Very low	165 Å²	165	141.4 Å²	141.4	86%	0.864	85%	0.85	S	S	*	*			trans	-63.9	133.1	160.6	-78.9	162.8	0	0	0	109.6	T915	T915-L917 PolarHBondContact O-N 3.21Å
918	V	33	Very low	32.9	Very low	136 Å²	136	145.7 Å²	145.7	82%	0.824	86%	0.858	S	S	*	*			trans	-104.1	134.5	164.9	-178.3	0	0	0	0	107.4
919	V	36.6	Very low	32.8	Very low	206 Å²	206	146.1 Å²	146.1	100%	1.248	86%	0.858	S	S	*	*			trans	-110.1	0	-179.3	179	0	0	0	0	109.3

Retrieved 919 of 919 residues in 523.9 ms (Link to these results)

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